2-naphthalen-2-ylsulfanyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-naphthalen-2-ylsulfanyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthylsulfanyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenylthio)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-ylsulfanyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-naphthylthio)-1-[4-(4-pyridylmethyl)piperazino]ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23N3OS/c26-22(17-27-21-6-5-19-3-1-2-4-20(19)15-21)25-13-11-24(12-14-25)16-18-7-9-23-10-8-18/h1-10,15H,11-14,16-17H2