3-azanyl-6-methyl-2-phenacylsulfanyl-pyrimidin-4-one

Systemtic Name: 3-azanyl-6-methyl-2-phenacylsulfanyl-pyrimidin-4-one Openeye Name: 3-amino-6-methyl-2-phenacylsulfanyl-pyrimidin-4-one CAS Name: 3-amino-6-methyl-2-(phenacylthio)-4-pyrimidinone IUPAC Name: 3-amino-6-methyl-2-phenacylsulfanylpyrimidin-4-one Traditional Name: 3-amino-6-methyl-2-(phenacylthio)pyrimidin-4-one Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)C2=CC=CC=C2)N

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)C2=CC=CC=C2)N

InChI

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