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

Systemtic Name: N-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]ethanamide Openeye Name: N-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetamide CAS Name: N-[4-oxo-2-(phenylmethylthio)-1H-pyrimidin-6-yl]acetamide IUPAC Name: N-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetamide Traditional Name: N-[2-(benzylthio)-4-keto-1H-pyrimidin-6-yl]acetamide Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O2S/c1-9(17)14-11-7-12(18)16-13(15-11)19-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H2,14,15,16,17,18)