4-methyl-N-[2-[[4-[4-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-oxidanylidene-butyl]piperidin-1-yl]methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[[4-[4-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-oxidanylidene-butyl]piperidin-1-yl]methyl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[2-[[4-[4-[3-(o-tolylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-oxo-butyl]-1-piperidyl]methyl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[2-[[4-[4-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-oxobutyl]-1-piperidinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[2-[[4-[4-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-oxobutyl]piperidin-1-yl]methyl]phenyl]benzenesulfonamide Traditional Name: N-[2-[[4-[4-keto-4-[3-(2-methylbenzyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butyl]piperidino]methyl]phenyl]-4-methyl-benzenesulfonamide Formula: C41H49N3O3S MolecularWeight: 663.91106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CN3CCC(CC3)CCCC(=O)C4=CC5=C(CCN(CC5)CC6=CC=CC=C6C)C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2CN3CCC(CC3)CCCC(=O)C4=CC5=C(CCN(CC5)CC6=CC=CC=C6C)C=C4

InChI

InChI=1S/C41H49N3O3S/c1-31-14-18-39(19-15-31)48(46,47)42-40-12-6-5-11-38(40)30-43-24-20-33(21-25-43)9-7-13-41(45)36-17-16-34-22-26-44(27-23-35(34)28-36)29-37-10-4-3-8-32(37)2/h3-6,8,10-12,14-19,28,33,42H,7,9,13,20-27,29-30H2,1-2H3