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

Systemtic Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(3-methylphenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid Openeye Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(m-tolyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid CAS Name: 7-(1,3-dimethyl-4-pyrazolyl)-1-(3-methylphenyl)-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 7-(1,3-dimethylpyrazol-4-yl)-1-(3-methylphenyl)-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylic acid Traditional Name: 7-(1,3-dimethylpyrazol-4-yl)-4-keto-1-(m-tolyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid Formula: C20H17N5O3S MolecularWeight: 407.44568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C(=CC(=N3)C4=CN(N=C4C)C)C(=O)O)C(=O)NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C(=CC(=N3)C4=CN(N=C4C)C)C(=O)O)C(=O)NC2=S

InChI

InChI=1S/C20H17N5O3S/c1-10-5-4-6-12(7-10)25-17-16(18(26)22-20(25)29)13(19(27)28)8-15(21-17)14-9-24(3)23-11(14)2/h4-9H,1-3H3,(H,27,28)(H,22,26,29)