1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-(2-methylbutyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-(2-methylbutyl)pyrrolidine-2-carboxamide Openeye Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(2-methylbutyl)pyrrolidine-2-carboxamide CAS Name: 1-[6-(3-bromoanilino)-4-pyrimidinyl]-N-(2-methylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(2-methylbutyl)pyrrolidine-2-carboxamide Traditional Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(2-methylbutyl)pyrrolidine-2-carboxamide Formula: C20H26BrN5O MolecularWeight: 432.35734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1CCCN1C2=CC(=NC=N2)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCC(C)CNC(=O)C1CCCN1C2=CC(=NC=N2)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H26BrN5O/c1-3-14(2)12-22-20(27)17-8-5-9-26(17)19-11-18(23-13-24-19)25-16-7-4-6-15(21)10-16/h4,6-7,10-11,13-14,17H,3,5,8-9,12H2,1-2H3,(H,22,27)(H,23,24,25)