(2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: (2S)-2-[(1-methyl-2-imidazolyl)thio]-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide IUPAC Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide Traditional Name: (2S)-2-[(1-methylimidazol-2-yl)thio]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C19H18N4O3S MolecularWeight: 382.43622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)SC3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3S/c1-13-8-9-15(16(12-13)23(25)26)21-18(24)17(14-6-4-3-5-7-14)27-19-20-10-11-22(19)2/h3-12,17H,1-2H3,(H,21,24)/t17-/m0/s1