N,4-dimethyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: N,4-dimethyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N,4-dimethyl-N-[2-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: N,4-dimethyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzenesulfonamide IUPAC Name: N,4-dimethyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-[2-keto-2-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]ethyl]-N,4-dimethyl-benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C23H31N3O3S/c1-19-9-11-22(12-10-19)30(28,29)24(3)18-23(27)26-14-6-13-25(15-16-26)17-21-8-5-4-7-20(21)2/h4-5,7-12H,6,13-18H2,1-3H3