2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-[(3,4-dimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-veratryl-acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H22N4O3S/c1-26-17-9-8-14(10-18(17)27-2)11-22-19(25)13-28-20-23-16(12-24(20)21)15-6-4-3-5-7-15/h3-10,12H,11,13,21H2,1-2H3,(H,22,25)