5-methyl-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 5-methyl-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C12H9N4O3S4- MolecularWeight: 385.48486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NN=C(S3)SC)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NN=C(S3)SC)C(=O)[O-]

InChI

InChI=1S/C12H10N4O3S4/c1-4-6-8(17)13-5(14-9(6)22-7(4)10(18)19)3-21-12-16-15-11(20-2)23-12/h3H2,1-2H3,(H,18,19)(H,13,14,17)/p-1