3-[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 3-[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]-5-methyl-4-oxo-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[[(4-ethyl-5-methyl-3-thiophenyl)-oxomethyl]amino]-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 3-[(4-ethyl-5-methylthiophene-3-carbonyl)amino]-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]-4-keto-5-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C16H14N3O4S3- MolecularWeight: 408.49506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C(=O)NN2C(=O)C3=C(NC2=S)SC(=C3C)C(=O)[O-])C

Isomeric SMILES

CCC1=C(SC=C1C(=O)NN2C(=O)C3=C(NC2=S)SC(=C3C)C(=O)[O-])C

InChI

InChI=1S/C16H15N3O4S3/c1-4-8-7(3)25-5-9(8)12(20)18-19-14(21)10-6(2)11(15(22)23)26-13(10)17-16(19)24/h5H,4H2,1-3H3,(H,17,24)(H,18,20)(H,22,23)/p-1