6-chloranyl-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]sulfanyl-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]sulfanyl-4-phenyl-1H-quinolin-2-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-6-chloro-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-chloro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[[2-(4-benzylpiperazino)-2-keto-ethyl]thio]-6-chloro-4-phenyl-carbostyril Formula: C28H26ClN3O2S MolecularWeight: 504.04294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H26ClN3O2S/c29-22-11-12-24-23(17-22)26(21-9-5-2-6-10-21)27(28(34)30-24)35-19-25(33)32-15-13-31(14-16-32)18-20-7-3-1-4-8-20/h1-12,17H,13-16,18-19H2,(H,30,34)