N-(2-phenylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(2-phenylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(2-phenylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-[2-(phenylthio)ethyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-phenylsulfanylethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[2-(phenylthio)ethyl]-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCCSC2=CC=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CC(=O)NCCSC2=CC=CC=C2)C3=NC=CC=N3

InChI

InChI=1S/C18H23N5OS/c24-17(19-9-14-25-16-5-2-1-3-6-16)15-22-10-12-23(13-11-22)18-20-7-4-8-21-18/h1-8H,9-15H2,(H,19,24)