1-(4-phenylpiperazin-1-yl)-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-(4-phenyl-1-piperazinyl)-2-(2-quinolinylthio)ethanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(4-phenylpiperazino)-2-(2-quinolylthio)ethanone Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3OS/c25-21(16-26-20-11-10-17-6-4-5-9-19(17)22-20)24-14-12-23(13-15-24)18-7-2-1-3-8-18/h1-11H,12-16H2