4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[4-(1H-benzimidazol-2-yl)-1-piperidyl]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[4-(1H-benzimidazol-2-yl)piperidino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O4S/c1-14(2)24-31(29,30)16-7-8-19(20(13-16)26(27)28)25-11-9-15(10-12-25)21-22-17-5-3-4-6-18(17)23-21/h3-8,13-15,24H,9-12H2,1-2H3,(H,22,23)