2-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole

Systemtic Name: 2-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole Openeye Name: 2-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole CAS Name: 2-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]-1-methylbenzimidazole IUPAC Name: 2-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1-methylbenzimidazole Traditional Name: 2-[[4-(2,5-dimethylphenyl)sulfonylpiperazino]methyl]-1-methyl-benzimidazole Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C21H26N4O2S/c1-16-8-9-17(2)20(14-16)28(26,27)25-12-10-24(11-13-25)15-21-22-18-6-4-5-7-19(18)23(21)3/h4-9,14H,10-13,15H2,1-3H3