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

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-5-yl-pyrimidine-5-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-5-yl-pyrimidine-5-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)-1-pyrrolidinyl]-N-(5-pyrimidinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-pyrimidin-5-ylpyrimidine-5-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-2-(2-methylolpyrrolidino)-N-(5-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=CN=CN=C3)N4CCCC4CO)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NC3=CN=CN=C3)N4CCCC4CO)Cl

InChI

InChI=1S/C22H24ClN7O3/c1-33-19-5-4-14(7-18(19)23)8-26-20-17(21(32)28-15-9-24-13-25-10-15)11-27-22(29-20)30-6-2-3-16(30)12-31/h4-5,7,9-11,13,16,31H,2-3,6,8,12H2,1H3,(H,28,32)(H,26,27,29)