N-[2-(phenylmethylsulfanyl)ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-[2-(phenylmethylthio)ethyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C19H25N5OS MolecularWeight: 371.4997

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCCSCC2=CC=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CC(=O)NCCSCC2=CC=CC=C2)C3=NC=CC=N3

InChI

InChI=1S/C19H25N5OS/c25-18(20-9-14-26-16-17-5-2-1-3-6-17)15-23-10-12-24(13-11-23)19-21-7-4-8-22-19/h1-8H,9-16H2,(H,20,25)