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

Systemtic Name: methyl 7-(1,3-dimethylpyrazol-4-yl)-1-(3-methylphenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 7-(1,3-dimethylpyrazol-4-yl)-1-(m-tolyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-(1,3-dimethyl-4-pyrazolyl)-1-(3-methylphenyl)-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 7-(1,3-dimethylpyrazol-4-yl)-1-(3-methylphenyl)-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 7-(1,3-dimethylpyrazol-4-yl)-4-keto-1-(m-tolyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C21H19N5O3S MolecularWeight: 421.47226

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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)OC)C(=O)NC2=S

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O3S/c1-11-6-5-7-13(8-11)26-18-17(19(27)23-21(26)30)14(20(28)29-4)9-16(22-18)15-10-25(3)24-12(15)2/h5-10H,1-4H3,(H,23,27,30)