2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole

Systemtic Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole Openeye Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-benzimidazole CAS Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-1-methylbenzimidazole IUPAC Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-methylbenzimidazole Traditional Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methyl]-1-methyl-benzimidazole Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C21H26N4O4S/c1-23-18-7-5-4-6-17(18)22-21(23)15-24-10-12-25(13-11-24)30(26,27)16-8-9-19(28-2)20(14-16)29-3/h4-9,14H,10-13,15H2,1-3H3