N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(1-benzyl-2-oxo-propyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(3-oxo-1-phenylbutan-2-yl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(3-oxo-1-phenylbutan-2-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(1-benzyl-2-keto-propyl)-2-(2-pyrimidylthio)acetamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C16H17N3O2S/c1-12(20)14(10-13-6-3-2-4-7-13)19-15(21)11-22-16-17-8-5-9-18-16/h2-9,14H,10-11H2,1H3,(H,19,21)