5-(4-ethanoylpiperazin-1-yl)carbonyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 5-(4-ethanoylpiperazin-1-yl)carbonyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-(4-acetylpiperazine-1-carbonyl)-2-benzylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-[(4-acetyl-1-piperazinyl)-oxomethyl]-2-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 5-(4-acetylpiperazine-1-carbonyl)-2-benzylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-(4-acetylpiperazine-1-carbonyl)-2-(benzylthio)-1H-pyrimidin-6-one Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CN=C(NC2=O)SCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CN=C(NC2=O)SCC3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3S/c1-13(23)21-7-9-22(10-8-21)17(25)15-11-19-18(20-16(15)24)26-12-14-5-3-2-4-6-14/h2-6,11H,7-10,12H2,1H3,(H,19,20,24)