(2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-4-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: (2R)-2-(1H-benzimidazol-2-ylthio)-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: (2R)-2-(1H-benzimidazol-2-ylthio)-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H16N4O4S/c1-10(26-17-19-12-5-3-4-6-13(12)20-17)16(22)18-14-8-7-11(21(23)24)9-15(14)25-2/h3-10H,1-2H3,(H,18,22)(H,19,20)/t10-/m1/s1