1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[benzyl(isopropyl)amino]-1-(4-tosylpiperazino)ethanone Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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