5-chloranyl-N-[(2-phenylmethoxypyridin-3-yl)methyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(2-phenylmethoxypyridin-3-yl)methyl]-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: N-[(2-benzyloxy-3-pyridyl)methyl]-5-chloro-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(2-phenylmethoxy-3-pyridinyl)methyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(2-phenylmethoxypyridin-3-yl)methyl]-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: N-[(2-benzoxy-3-pyridyl)methyl]-5-chloro-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C22H22ClN5O2 MolecularWeight: 423.89538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NCC3=C(N=CC=C3)OCC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NCC3=C(N=CC=C3)OCC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H22ClN5O2/c23-18-14-26-22(28-11-4-5-12-28)27-19(18)20(29)25-13-17-9-6-10-24-21(17)30-15-16-7-2-1-3-8-16/h1-3,6-10,14H,4-5,11-13,15H2,(H,25,29)