4-oxidanylidene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-oxidanylidene-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile Openeye Name: 4-oxo-2-thioxo-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile CAS Name: 4-oxo-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 4-oxo-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-2-thioxo-6-(3,4,5-trimethoxyphenyl)-1H-pyrimidine-5-carbonitrile Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)NC(=S)N2)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)NC(=S)N2)C#N

InChI

InChI=1S/C14H13N3O4S/c1-19-9-4-7(5-10(20-2)12(9)21-3)11-8(6-15)13(18)17-14(22)16-11/h4-5H,1-3H3,(H2,16,17,18,22)