2-[(2,4-dimethylphenyl)methyl-methyl-amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl-methyl-amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(2,4-dimethylphenyl)methyl-methyl-amino]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[(2,4-dimethylphenyl)methyl-methylamino]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(2,4-dimethylphenyl)methyl-methylamino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(2,4-dimethylbenzyl)-methyl-amino]-1-(4-tosylpiperazino)ethanone 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)N2CCN(CC2)C(=O)CN(C)CC3=C(C=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)CC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H31N3O3S/c1-18-6-9-22(10-7-18)30(28,29)26-13-11-25(12-14-26)23(27)17-24(4)16-21-8-5-19(2)15-20(21)3/h5-10,15H,11-14,16-17H2,1-4H3