N,N-diethyl-1-methyl-2-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-1-methyl-2-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-1-methyl-2-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-1-methyl-2-[[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-1-methyl-2-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-1-methyl-2-[(4-p-toluoylpiperazino)methyl]benzimidazole-5-sulfonamide Formula: C25H33N5O3S MolecularWeight: 483.62622

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C25H33N5O3S/c1-5-30(6-2)34(32,33)21-11-12-23-22(17-21)26-24(27(23)4)18-28-13-15-29(16-14-28)25(31)20-9-7-19(3)8-10-20/h7-12,17H,5-6,13-16,18H2,1-4H3