2-[[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole

Systemtic Name: 2-[[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole Openeye Name: 2-[[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole CAS Name: 2-[[4-(4-methoxy-3-methylphenyl)sulfonyl-1-piperazinyl]methyl]-1-methylbenzimidazole IUPAC Name: 2-[[4-(4-methoxy-3-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1-methylbenzimidazole Traditional Name: 2-[[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazino]methyl]-1-methyl-benzimidazole Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3S/c1-16-14-17(8-9-20(16)28-3)29(26,27)25-12-10-24(11-13-25)15-21-22-18-6-4-5-7-19(18)23(21)2/h4-9,14H,10-13,15H2,1-3H3