6-(2-bromophenyl)-2-[(4-fluorophenyl)amino]-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrido[2,3-d]pyrimidine-7-carboxamide

Systemtic Name: 6-(2-bromophenyl)-2-[(4-fluorophenyl)amino]-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrido[2,3-d]pyrimidine-7-carboxamide Openeye Name: 6-(2-bromophenyl)-2-(4-fluoroanilino)-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrido[2,3-d]pyrimidine-7-carboxamide CAS Name: 6-(2-bromophenyl)-2-(4-fluoroanilino)-N-[[(3S)-3-pyrrolidinyl]methyl]-7-pyrido[2,3-d]pyrimidinecarboxamide IUPAC Name: 6-(2-bromophenyl)-2-(4-fluoroanilino)-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrido[2,3-d]pyrimidine-7-carboxamide Traditional Name: 6-(2-bromophenyl)-2-(4-fluoroanilino)-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrido[2,3-d]pyrimidine-7-carboxamide Formula: C25H22BrFN6O MolecularWeight: 521.384183

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1CNC(=O)C2=C(C=C3C=NC(=NC3=N2)NC4=CC=C(C=C4)F)C5=CC=CC=C5Br

Isomeric SMILES

C1CNC[C@H]1CNC(=O)C2=C(C=C3C=NC(=NC3=N2)NC4=CC=C(C=C4)F)C5=CC=CC=C5Br

InChI

InChI=1S/C25H22BrFN6O/c26-21-4-2-1-3-19(21)20-11-16-14-30-25(31-18-7-5-17(27)6-8-18)33-23(16)32-22(20)24(34)29-13-15-9-10-28-12-15/h1-8,11,14-15,28H,9-10,12-13H2,(H,29,34)(H,30,31,32,33)/t15-/m0/s1