4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-2-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-2-yl-pyrimidine-5-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-2-yl-pyrimidine-5-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)-1-pyrrolidinyl]-N-(2-pyrimidinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-2-ylpyrimidine-5-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-2-(2-methylolpyrrolidino)-N-(2-pyrimidyl)pyrimidine-5-carboxamide Formula: C22H24ClN7O3 MolecularWeight: 469.92406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NC3=NC=CC=N3)N4CCCC4CO)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NC3=NC=CC=N3)N4CCCC4CO)Cl

InChI

InChI=1S/C22H24ClN7O3/c1-33-18-6-5-14(10-17(18)23)11-26-19-16(20(32)29-21-24-7-3-8-25-21)12-27-22(28-19)30-9-2-4-15(30)13-31/h3,5-8,10,12,15,31H,2,4,9,11,13H2,1H3,(H,26,27,28)(H,24,25,29,32)