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

Systemtic Name: 7-cyano-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-olate Openeye Name: 7-cyano-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate CAS Name: 7-cyano-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate IUPAC Name: 7-cyano-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate Traditional Name: 7-cyano-4-keto-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1H-thieno[3,2-d]pyrimidin-2-olate Formula: C16H10N3O4S2- MolecularWeight: 372.3983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N

InChI

InChI=1S/C16H11N3O4S2/c1-23-9-4-2-8(3-5-9)11(20)7-24-15-10(6-17)12-13(25-15)14(21)19-16(22)18-12/h2-5H,7H2,1H3,(H2,18,19,21,22)/p-1