2,4-bis(oxidanylidene)-6-(pyridin-2-ylmethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 2,4-bis(oxidanylidene)-6-(pyridin-2-ylmethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 2,4-dioxo-6-(2-pyridylmethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile CAS Name: 2,4-dioxo-6-(2-pyridinylmethylthio)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile IUPAC Name: 2,4-dioxo-6-(pyridin-2-ylmethylsulfanyl)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 2,4-diketo-6-(2-pyridylmethylthio)-1H-thieno[3,2-d]pyrimidine-7-carbonitrile Formula: C13H8N4O2S2 MolecularWeight: 316.35822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

Isomeric SMILES

C1=CC=NC(=C1)CSC2=C(C3=C(S2)C(=O)NC(=O)N3)C#N

InChI

InChI=1S/C13H8N4O2S2/c14-5-8-9-10(11(18)17-13(19)16-9)21-12(8)20-6-7-3-1-2-4-15-7/h1-4H,6H2,(H2,16,17,18,19)