2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)acetamide Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CCC#N)C(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CCC#N)C(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

InChI

InChI=1S/C22H23N5OS/c1-16-9-10-19(13-17(16)2)26(12-6-11-23)21(28)15-29-22-25-20(14-27(22)24)18-7-4-3-5-8-18/h3-5,7-10,13-14H,6,12,15,24H2,1-2H3