2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(3-oxidanylidene-1-phenyl-butan-2-yl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(3-oxidanylidene-1-phenyl-butan-2-yl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(1-benzyl-2-oxo-propyl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(3-oxo-1-phenylbutan-2-yl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(3-oxo-1-phenylbutan-2-yl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(1-benzyl-2-keto-propyl)acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-15(26)18(12-16-8-4-2-5-9-16)23-20(27)14-28-21-24-19(13-25(21)22)17-10-6-3-7-11-17/h2-11,13,18H,12,14,22H2,1H3,(H,23,27)