4-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1H-quinoxaline-2,3-dione

Systemtic Name: 4-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1H-quinoxaline-2,3-dione Openeye Name: 4-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]-1H-quinoxaline-2,3-dione CAS Name: 4-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-1H-quinoxaline-2,3-dione IUPAC Name: 4-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-1H-quinoxaline-2,3-dione Traditional Name: 4-[2-keto-2-(4-tosylpiperazino)ethyl]-1H-quinoxaline-2,3-quinone Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4NC(=O)C3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4NC(=O)C3=O

InChI

InChI=1S/C21H22N4O5S/c1-15-6-8-16(9-7-15)31(29,30)24-12-10-23(11-13-24)19(26)14-25-18-5-3-2-4-17(18)22-20(27)21(25)28/h2-9H,10-14H2,1H3,(H,22,27)