7-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyethyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid

Systemtic Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyethyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid Openeye Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyethyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid CAS Name: 7-(1,3-dimethyl-4-pyrazolyl)-1-(2-methoxyethyl)-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyethyl)-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylic acid Traditional Name: 7-(1,3-dimethylpyrazol-4-yl)-4-keto-1-(2-methoxyethyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC3=C(C(=C2)C(=O)O)C(=O)NC(=S)N3CCOC)C

Isomeric SMILES

CC1=NN(C=C1C2=NC3=C(C(=C2)C(=O)O)C(=O)NC(=S)N3CCOC)C

InChI

InChI=1S/C16H17N5O4S/c1-8-10(7-20(2)19-8)11-6-9(15(23)24)12-13(17-11)21(4-5-25-3)16(26)18-14(12)22/h6-7H,4-5H2,1-3H3,(H,23,24)(H,18,22,26)