7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-[3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-[3-methyl-4-(m-tolyl)piperazino]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C22H27N3O3S/c1-16-5-3-7-19(13-16)25-12-11-24(15-17(25)2)29(27,28)20-9-10-21-18(14-20)6-4-8-22(26)23-21/h3,5,7,9-10,13-14,17H,4,6,8,11-12,15H2,1-2H3,(H,23,26)