N-(2-methoxy-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[(1-methyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-[(1-methylbenzimidazol-2-yl)thio]propionamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3N2C

InChI

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