methyl 1-cyclopropyl-7-(4-fluorophenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: methyl 1-cyclopropyl-7-(4-fluorophenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 1-cyclopropyl-7-(4-fluorophenyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 1-cyclopropyl-7-(4-fluorophenyl)-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 1-cyclopropyl-7-(4-fluorophenyl)-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 1-cyclopropyl-7-(4-fluorophenyl)-4-keto-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C18H14FN3O3S MolecularWeight: 371.385463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2C3CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2C3CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H14FN3O3S/c1-25-17(24)12-8-13(9-2-4-10(19)5-3-9)20-15-14(12)16(23)21-18(26)22(15)11-6-7-11/h2-5,8,11H,6-7H2,1H3,(H,21,23,26)