4-[[3-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[3-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[[3-[3-(1H-benzimidazol-2-yl)-1-piperidyl]-3-oxo-propyl]amino]-3-nitro-benzenesulfonamide CAS Name: 4-[[3-[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-3-oxopropyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[[3-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-oxopropyl]amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[[3-[3-(1H-benzimidazol-2-yl)piperidino]-3-keto-propyl]amino]-3-nitro-benzenesulfonamide Formula: C21H24N6O5S MolecularWeight: 472.51746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC(CN(C1)C(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N6O5S/c22-33(31,32)15-7-8-18(19(12-15)27(29)30)23-10-9-20(28)26-11-3-4-14(13-26)21-24-16-5-1-2-6-17(16)25-21/h1-2,5-8,12,14,23H,3-4,9-11,13H2,(H,24,25)(H2,22,31,32)