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

Systemtic Name: 1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyrrolidine-2-carboxamide Openeye Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrrolidine-2-carboxamide CAS Name: 1-[6-(3-bromoanilino)-4-pyrimidinyl]-N-[[(2S)-2-oxolanyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyrrolidine-2-carboxamide Traditional Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrrolidine-2-carboxamide Formula: C20H24BrN5O2 MolecularWeight: 446.34086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC(=NC=N2)NC3=CC(=CC=C3)Br)C(=O)NCC4CCCO4

Isomeric SMILES

C1C[C@H](OC1)CNC(=O)C2CCCN2C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C20H24BrN5O2/c21-14-4-1-5-15(10-14)25-18-11-19(24-13-23-18)26-8-2-7-17(26)20(27)22-12-16-6-3-9-28-16/h1,4-5,10-11,13,16-17H,2-3,6-9,12H2,(H,22,27)(H,23,24,25)/t16-,17?/m0/s1