3-(4-methoxyphenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 3-(4-methoxyphenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile Openeye Name: 3-(4-methoxyphenyl)-6-methylsulfanyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile CAS Name: 3-(4-methoxyphenyl)-6-(methylthio)-2,4-dioxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 3-(4-methoxyphenyl)-6-methylsulfanyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2,4-diketo-3-(4-methoxyphenyl)-6-(methylthio)-1H-pyrimidine-5-carbonitrile Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=C(NC2=O)SC)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=C(NC2=O)SC)C#N

InChI

InChI=1S/C13H11N3O3S/c1-19-9-5-3-8(4-6-9)16-12(17)10(7-14)11(20-2)15-13(16)18/h3-6H,1-2H3,(H,15,18)