(2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-methoxy-4-nitrophenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]propanamide IUPAC Name: (2R)-N-(2-methoxy-4-nitrophenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]propionamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)S[C@H](C)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H18N4O4S/c1-10-4-6-13-15(8-10)21-18(20-13)27-11(2)17(23)19-14-7-5-12(22(24)25)9-16(14)26-3/h4-9,11H,1-3H3,(H,19,23)(H,20,21)/t11-/m1/s1