2-[[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole

Systemtic Name: 2-[[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole Openeye Name: 2-[[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole CAS Name: 2-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-benzimidazole IUPAC Name: 2-[[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole Traditional Name: 2-[[4-(4-tert-butylphenyl)sulfonylpiperazino]methyl]-1H-benzimidazole Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H28N4O2S/c1-22(2,3)17-8-10-18(11-9-17)29(27,28)26-14-12-25(13-15-26)16-21-23-19-6-4-5-7-20(19)24-21/h4-11H,12-16H2,1-3H3,(H,23,24)