1-[4-(2-chlorophenyl)piperazin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-[4-(2-chlorophenyl)-1-piperazinyl]-2-(2-quinolinylthio)ethanone IUPAC Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-[4-(2-chlorophenyl)piperazino]-2-(2-quinolylthio)ethanone Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H20ClN3OS/c22-17-6-2-4-8-19(17)24-11-13-25(14-12-24)21(26)15-27-20-10-9-16-5-1-3-7-18(16)23-20/h1-10H,11-15H2