1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-(pyridin-4-ylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-(pyridin-4-ylmethylsulfanyl)ethanone Openeye Name: 1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-(4-pyridylmethylsulfanyl)ethanone CAS Name: 1-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-2-(pyridin-4-ylmethylthio)ethanone IUPAC Name: 1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-(pyridin-4-ylmethylsulfanyl)ethanone Traditional Name: 1-(4-p-anisylpiperazino)-2-(4-pyridylmethylthio)ethanone Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CSCC3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CSCC3=CC=NC=C3

InChI

InChI=1S/C20H25N3O2S/c1-25-19-4-2-17(3-5-19)14-22-10-12-23(13-11-22)20(24)16-26-15-18-6-8-21-9-7-18/h2-9H,10-16H2,1H3