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

Systemtic Name: 5-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 5-methyl-2-[(5-methyl-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-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C12H9N4O3S3- MolecularWeight: 353.41986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4O3S3/c1-4-7-9(17)13-6(3-20-12-16-15-5(2)21-12)14-10(7)22-8(4)11(18)19/h3H2,1-2H3,(H,18,19)(H,13,14,17)/p-1