2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)-N-isopropyl-acetamide CAS Name: 2-[4-oxo-2-(phenylmethylthio)-1H-pyrimidin-6-yl]-N-propan-2-ylacetamide IUPAC Name: 2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)-N-propan-2-ylacetamide Traditional Name: 2-[2-(benzylthio)-4-keto-1H-pyrimidin-6-yl]-N-isopropyl-acetamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O2S/c1-11(2)17-14(20)8-13-9-15(21)19-16(18-13)22-10-12-6-4-3-5-7-12/h3-7,9,11H,8,10H2,1-2H3,(H,17,20)(H,18,19,21)