1-(2-methyl-4-methylsulfanyl-phenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 1-(2-methyl-4-methylsulfanyl-phenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 1-(2-methyl-4-methylsulfanyl-phenyl)-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-[2-methyl-4-(methylthio)phenyl]-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1-(2-methyl-4-methylsulfanylphenyl)-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 2,4-diketo-1-[2-methyl-4-(methylthio)phenyl]pyrimidine-5-carbonitrile Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC)N2C=C(C(=O)NC2=O)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)SC)N2C=C(C(=O)NC2=O)C#N

InChI

InChI=1S/C13H11N3O2S/c1-8-5-10(19-2)3-4-11(8)16-7-9(6-14)12(17)15-13(16)18/h3-5,7H,1-2H3,(H,15,17,18)