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

Systemtic Name: 1-methyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]sulfanyl-quinolin-2-one Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-1-methyl-quinolin-2-one CAS Name: 1-methyl-4-[[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]thio]-2-quinolinone IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl-1-methylquinolin-2-one Traditional Name: 4-[[2-(4-benzylpiperazino)-2-keto-ethyl]thio]-1-methyl-carbostyril Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-24-20-10-6-5-9-19(20)21(15-22(24)27)29-17-23(28)26-13-11-25(12-14-26)16-18-7-3-2-4-8-18/h2-10,15H,11-14,16-17H2,1H3