N-(4-fluoranyl-3-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propanamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propionamide Formula: C17H15FN4O4S MolecularWeight: 390.388803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15FN4O4S/c1-9(16(23)19-10-3-5-12(18)15(7-10)22(24)25)27-17-20-13-6-4-11(26-2)8-14(13)21-17/h3-9H,1-2H3,(H,19,23)(H,20,21)