N-cyclopentyl-3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide

Systemtic Name: N-cyclopentyl-3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide Openeye Name: N-cyclopentyl-3-[4-(o-tolylmethyl)-1,4-diazepane-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopentyl-3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopentyl-3-[4-[(2-methylphenyl)methyl]-1,4-diazepane-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopentyl-3-[4-(2-methylbenzyl)-1,4-diazepane-1-carbonyl]benzenesulfonamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4CCCC4

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4CCCC4

InChI

InChI=1S/C25H33N3O3S/c1-20-8-2-3-9-22(20)19-27-14-7-15-28(17-16-27)25(29)21-10-6-13-24(18-21)32(30,31)26-23-11-4-5-12-23/h2-3,6,8-10,13,18,23,26H,4-5,7,11-12,14-17,19H2,1H3