3-[(4,5-dimethylthiophen-3-yl)carbonylamino]-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 3-[(4,5-dimethylthiophen-3-yl)carbonylamino]-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 3-[(4,5-dimethylthiophene-3-carbonyl)amino]-5-methyl-4-oxo-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 3-[[(4,5-dimethyl-3-thiophenyl)-oxomethyl]amino]-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 3-[(4,5-dimethylthiophene-3-carbonyl)amino]-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 3-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-keto-5-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C15H13N3O4S3 MolecularWeight: 395.47642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1C(=O)NN2C(=O)C3=C(NC2=S)SC(=C3C)C(=O)O)C

Isomeric SMILES

CC1=C(SC=C1C(=O)NN2C(=O)C3=C(NC2=S)SC(=C3C)C(=O)O)C

InChI

InChI=1S/C15H13N3O4S3/c1-5-7(3)24-4-8(5)11(19)17-18-13(20)9-6(2)10(14(21)22)25-12(9)16-15(18)23/h4H,1-3H3,(H,16,23)(H,17,19)(H,21,22)