N-(2-chloranyl-5-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propionamide Formula: C17H15ClN4O4S MolecularWeight: 406.8434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)SC2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)SC2=NC3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C17H15ClN4O4S/c1-9(16(23)19-14-7-10(22(24)25)3-5-12(14)18)27-17-20-13-6-4-11(26-2)8-15(13)21-17/h3-9H,1-2H3,(H,19,23)(H,20,21)