4-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[[3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[3-[(4-tosylpiperazino)methyl]benzoyl]-1,3-dihydroquinoxalin-2-one Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CC(=O)NC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CC(=O)NC5=CC=CC=C54

InChI

InChI=1S/C27H28N4O4S/c1-20-9-11-23(12-10-20)36(34,35)30-15-13-29(14-16-30)18-21-5-4-6-22(17-21)27(33)31-19-26(32)28-24-7-2-3-8-25(24)31/h2-12,17H,13-16,18-19H2,1H3,(H,28,32)