2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(3,4-dimethoxyphenyl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c1-13(19(25)22-15-9-10-17(26-2)18(11-15)27-3)28-20-23-16(12-24(20)21)14-7-5-4-6-8-14/h4-13H,21H2,1-3H3,(H,22,25)