7-cyano-6-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-olate

Systemtic Name: 7-cyano-6-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-olate Openeye Name: 7-cyano-6-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate CAS Name: 7-cyano-6-[[2-[2-(methylthio)anilino]-2-oxoethyl]thio]-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate IUPAC Name: 7-cyano-6-[2-(2-methylsulfanylanilino)-2-oxoethyl]sulfanyl-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate Traditional Name: 7-cyano-4-keto-6-[[2-keto-2-[2-(methylthio)anilino]ethyl]thio]-1H-thieno[3,2-d]pyrimidin-2-olate Formula: C16H11N4O3S3- MolecularWeight: 403.47854

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

InChI

InChI=1S/C16H12N4O3S3/c1-24-10-5-3-2-4-9(10)18-11(21)7-25-15-8(6-17)12-13(26-15)14(22)20-16(23)19-12/h2-5H,7H2,1H3,(H,18,21)(H2,19,20,22,23)/p-1