2-naphthalen-2-ylsulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-naphthalen-2-ylsulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-(2-naphthylsulfanyl)-1-[4-(4-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenylthio)-1-(4-pyridin-4-yl-1-piperazinyl)ethanone IUPAC Name: 2-naphthalen-2-ylsulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-(2-naphthylthio)-1-[4-(4-pyridyl)piperazino]ethanone Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

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