1-methyl-4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinolin-2-one

Systemtic Name: 1-methyl-4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinolin-2-one Openeye Name: 1-methyl-4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-quinolin-2-one CAS Name: 1-methyl-4-[[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethyl]thio]-2-quinolinone IUPAC Name: 1-methyl-4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinolin-2-one Traditional Name: 4-[[2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl]thio]-1-methyl-carbostyril Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c1-23-19-5-3-2-4-18(19)20(14-21(23)27)31-15-22(28)25-12-10-24(11-13-25)16-6-8-17(9-7-16)26(29)30/h2-9,14H,10-13,15H2,1H3