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

Systemtic Name: methyl 7-(3-bromophenyl)-1-cyclopropyl-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 7-(3-bromophenyl)-1-cyclopropyl-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-(3-bromophenyl)-1-cyclopropyl-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 7-(3-bromophenyl)-1-cyclopropyl-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 7-(3-bromophenyl)-1-cyclopropyl-4-keto-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C18H14BrN3O3S MolecularWeight: 432.29106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrN3O3S/c1-25-17(24)12-8-13(9-3-2-4-10(19)7-9)20-15-14(12)16(23)21-18(26)22(15)11-5-6-11/h2-4,7-8,11H,5-6H2,1H3,(H,21,23,26)