N,N,1-trimethyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-5-carboxamide

Systemtic Name: N,N,1-trimethyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-5-carboxamide Openeye Name: N,N,1-trimethyl-2-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzimidazole-5-carboxamide CAS Name: N,N,1-trimethyl-2-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-5-benzimidazolecarboxamide IUPAC Name: N,N,1-trimethyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole-5-carboxamide Traditional Name: N,N,1-trimethyl-2-[(4-tosylpiperazino)methyl]benzimidazole-5-carboxamide Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(N3C)C=CC(=C4)C(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(N3C)C=CC(=C4)C(=O)N(C)C

InChI

InChI=1S/C23H29N5O3S/c1-17-5-8-19(9-6-17)32(30,31)28-13-11-27(12-14-28)16-22-24-20-15-18(23(29)25(2)3)7-10-21(20)26(22)4/h5-10,15H,11-14,16H2,1-4H3