N-(2-methylpropyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-(2-methylpropyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide Openeye Name: N-isobutyl-2-(2-methylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-(2-methylpropyl)-2-[2-(methylthio)-6-oxo-4-phenyl-1-pyrimidinyl]acetamide IUPAC Name: N-(2-methylpropyl)-2-(2-methylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-isobutyl-2-[6-keto-2-(methylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN1C(=O)C=C(N=C1SC)C2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)CN1C(=O)C=C(N=C1SC)C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O2S/c1-12(2)10-18-15(21)11-20-16(22)9-14(19-17(20)23-3)13-7-5-4-6-8-13/h4-9,12H,10-11H2,1-3H3,(H,18,21)