7-azanyl-5-(furan-2-yl)-4-oxidanylidene-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile

Systemtic Name: 7-azanyl-5-(furan-2-yl)-4-oxidanylidene-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Openeye Name: 7-amino-5-(2-furyl)-4-oxo-2-thioxo-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile CAS Name: 7-amino-5-(2-furanyl)-4-oxo-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile IUPAC Name: 7-amino-5-(furan-2-yl)-4-oxo-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Traditional Name: 7-amino-5-(2-furyl)-4-keto-2-thioxo-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Formula: C11H8N6O2S MolecularWeight: 288.28522

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2C3C(=O)NC(=S)N=C3N=C(N2C#N)N

Isomeric SMILES

C1=COC(=C1)C2C3C(=O)NC(=S)N=C3N=C(N2C#N)N

InChI

InChI=1S/C11H8N6O2S/c12-4-17-7(5-2-1-3-19-5)6-8(14-10(17)13)15-11(20)16-9(6)18/h1-3,6-7H,(H3,13,14,15,16,18,20)