6-aminocarbonyl-2-(cyanomethylsulfanyl)-5-methyl-thieno[2,3-d]pyrimidin-4-olate

Systemtic Name: 6-aminocarbonyl-2-(cyanomethylsulfanyl)-5-methyl-thieno[2,3-d]pyrimidin-4-olate Openeye Name: 6-carbamoyl-2-(cyanomethylsulfanyl)-5-methyl-thieno[2,3-d]pyrimidin-4-olate CAS Name: 6-carbamoyl-2-(cyanomethylthio)-5-methyl-4-thieno[2,3-d]pyrimidinolate IUPAC Name: 6-carbamoyl-2-(cyanomethylsulfanyl)-5-methylthieno[2,3-d]pyrimidin-4-olate Traditional Name: 6-carbamoyl-2-(cyanomethylthio)-5-methyl-thieno[2,3-d]pyrimidin-4-olate Formula: C10H7N4O2S2- MolecularWeight: 279.31818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)[O-])SCC#N)C(=O)N

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)[O-])SCC#N)C(=O)N

InChI

InChI=1S/C10H8N4O2S2/c1-4-5-8(16)13-10(17-3-2-11)14-9(5)18-6(4)7(12)15/h3H2,1H3,(H2,12,15)(H,13,14,16)/p-1