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

Systemtic Name: 1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: 1-[6-(3-bromoanilino)-4-pyrimidinyl]-N-[(3-methoxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-m-anisyl-pyrrolidine-2-carboxamide Formula: C23H24BrN5O2 MolecularWeight: 482.37296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2CCCN2C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2CCCN2C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H24BrN5O2/c1-31-19-8-2-5-16(11-19)14-25-23(30)20-9-4-10-29(20)22-13-21(26-15-27-22)28-18-7-3-6-17(24)12-18/h2-3,5-8,11-13,15,20H,4,9-10,14H2,1H3,(H,25,30)(H,26,27,28)