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

Systemtic Name: 4-methyl-N-[1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-methylsulfanyl-1-[4-(p-tolylmethyl)-1,4-diazepane-1-carbonyl]propyl]benzenesulfonamide CAS Name: 4-methyl-N-[1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-(methylthio)-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[1-[4-(4-methylbenzyl)-1,4-diazepane-1-carbonyl]-3-(methylthio)propyl]benzenesulfonamide Formula: C25H35N3O3S2 MolecularWeight: 489.6937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C(CCSC)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C(CCSC)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H35N3O3S2/c1-20-5-9-22(10-6-20)19-27-14-4-15-28(17-16-27)25(29)24(13-18-32-3)26-33(30,31)23-11-7-21(2)8-12-23/h5-12,24,26H,4,13-19H2,1-3H3