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SDF/Mol File of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide (C22H25N3OS)

Identification of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide Chemical Compound

2D chemical structure image of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
Chemical Formula C22H25N3OS
Molecular Weight 379.5184 g/mol
IUPAC Name N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
SMILES String CN(C)C(CNC(=O)Cc1csc(n1)c2ccccc2)c3ccc(C)cc3
InChI InChI=1S/C22H25N3OS/c1-16-9-11-17(12-10-16)20(25(2)3)14-23-21(26)13-19-15-27-22(24-19)18-7-5-4-6-8-18/h4-12,15,20H,13-14H2,1-3H3,(H,23,26)
InChIKey RKRXURZEGNADFZ-UHFFFAOYSA-N

Structure Data File (SDF/MOL File) Description

The structure data file (SDF/MOL File) of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide is available for download. Click the link below to start downloading.

Download structure data file (SDF/MOL File)

The structure data file (SDF/MOL File) contains the information about the atoms, bonds, connectivity and coordinates of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide molecule. It starts with a header block, followed by "connection table’, which describes the structural relationships and properties of the atoms.

The structure data file (SDF/MOL File) available above can be imported to most of the chemistry-related software packages, performing further scientific analysis. Most of the computational software and visualization program require the structural information of the target molecule, and the above structure data file (SDF/MOL File) can be a good option.

3D chemical structure image of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
Ball-and-stick model of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide

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  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

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Additional Information for Identifying N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide Molecule

  • Other names (synonyms) or registry numbers of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide

    The N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide including the registry numbers are listed below, if available:



    None available.


N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide Identification Summary Frequently Asked Questions (FAQs)

What’s the N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide formula?
C22H25N3OS
How many atoms and what elements are included in the N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide molecule?
52 atom(s) - 25 Hydrogen atom(s), 22 Carbon atom(s), 3 Nitrogen atom(s), 1 Oxygen atom(s), and 1 Sulfur atom(s)
How many chemical bonds and what kind of bonds are in the N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide structure?
54 bond(s) - 29 non-H bond(s), 18 multiple bond(s), 7 rotatable bond(s), 1 double bond(s), 17 aromatic bond(s), 1 five-membered ring(s), 2 six-membered ring(s), 1 secondary amide(s) (aliphatic), 1 tertiary amine(s) (aliphatic), and 1 Thiazole(s)
What’s the N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide’s molar mass?
379.5184 g/mol
What’s the SMILES structure of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
CN(C)C(CNC(=O)Cc1csc(n1)c2ccccc2)c3ccc(C)cc3
What’s the InChI code of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
InChI=1S/C22H25N3OS/c1-16-9-11-17(12-10-16)20(25(2)3)14-23-21(26)13-19-15-27-22(24-19)18-7-5-4-6-8-18/h4-12,15,20H,13-14H2,1-3H3,(H,23,26)
What’s the InChIKey format of N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
RKRXURZEGNADFZ-UHFFFAOYSA-N

33 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

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