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

Systemtic Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[4-(2-naphthylsulfonyl)piperazino]-2-(2-pyridylthio)ethanone Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=CC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=CC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3O3S2/c25-21(16-28-20-7-3-4-10-22-20)23-11-13-24(14-12-23)29(26,27)19-9-8-17-5-1-2-6-18(17)15-19/h1-10,15H,11-14,16H2