N-cyclopropyl-2-methoxy-5-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide

Systemtic Name: N-cyclopropyl-2-methoxy-5-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide Openeye Name: N-cyclopropyl-2-methoxy-5-[4-(p-tolylmethyl)-1,4-diazepane-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-2-methoxy-5-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methoxy-5-[4-[(4-methylphenyl)methyl]-1,4-diazepane-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-2-methoxy-5-[4-(4-methylbenzyl)-1,4-diazepane-1-carbonyl]benzenesulfonamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)NC4CC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)NC4CC4

InChI

InChI=1S/C24H31N3O4S/c1-18-4-6-19(7-5-18)17-26-12-3-13-27(15-14-26)24(28)20-8-11-22(31-2)23(16-20)32(29,30)25-21-9-10-21/h4-8,11,16,21,25H,3,9-10,12-15,17H2,1-2H3