2-[(3-acetamidophenyl)amino]-6-(2-bromophenyl)pyrido[2,3-d]pyrimidine-7-carboxylic acid

Systemtic Name: 2-[(3-acetamidophenyl)amino]-6-(2-bromophenyl)pyrido[2,3-d]pyrimidine-7-carboxylic acid Openeye Name: 2-(3-acetamidoanilino)-6-(2-bromophenyl)pyrido[2,3-d]pyrimidine-7-carboxylic acid CAS Name: 2-(3-acetamidoanilino)-6-(2-bromophenyl)-7-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 2-(3-acetamidoanilino)-6-(2-bromophenyl)pyrido[2,3-d]pyrimidine-7-carboxylic acid Traditional Name: 2-(3-acetamidoanilino)-6-(2-bromophenyl)pyrido[2,3-d]pyrimidine-7-carboxylic acid Formula: C22H16BrN5O3 MolecularWeight: 478.29814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC2=NC3=NC(=C(C=C3C=N2)C4=CC=CC=C4Br)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC2=NC3=NC(=C(C=C3C=N2)C4=CC=CC=C4Br)C(=O)O

InChI

InChI=1S/C22H16BrN5O3/c1-12(29)25-14-5-4-6-15(10-14)26-22-24-11-13-9-17(16-7-2-3-8-18(16)23)19(21(30)31)27-20(13)28-22/h2-11H,1H3,(H,25,29)(H,30,31)(H,24,26,27,28)