1-[2-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole

Systemtic Name: 1-[2-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole Openeye Name: 1-[2-[[4-(p-tolylmethyl)-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole CAS Name: 1-[2-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole IUPAC Name: 1-[2-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole Traditional Name: 1-[2-[[4-(4-methylbenzyl)-1,4-diazepan-1-yl]sulfonyl]ethyl]benzimidazole Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)CCN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)CCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H28N4O2S/c1-19-7-9-20(10-8-19)17-24-11-4-12-26(14-13-24)29(27,28)16-15-25-18-23-21-5-2-3-6-22(21)25/h2-3,5-10,18H,4,11-17H2,1H3