N,N-dimethyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1-propyl-benzimidazole-5-sulfonamide CAS Name: N,N-dimethyl-2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: N,N-dimethyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: N,N-dimethyl-2-[[4-(4-nitrophenyl)piperazino]methyl]-1-propyl-benzimidazole-5-sulfonamide Formula: C23H30N6O4S MolecularWeight: 486.5871

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H30N6O4S/c1-4-11-28-22-10-9-20(34(32,33)25(2)3)16-21(22)24-23(28)17-26-12-14-27(15-13-26)18-5-7-19(8-6-18)29(30)31/h5-10,16H,4,11-15,17H2,1-3H3