4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyridine-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-[2-(hydroxymethyl)-1-pyrrolidinyl]-N-(2-pyrimidinylmethyl)-3-pyridinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-(2-methylolpyrrolidino)-N-(2-pyrimidylmethyl)nicotinamide Formula: C24H27ClN6O3 MolecularWeight: 482.96258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=CC(=NC=C2C(=O)NCC3=NC=CC=N3)N4CCCC4CO)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=CC(=NC=C2C(=O)NCC3=NC=CC=N3)N4CCCC4CO)Cl

InChI

InChI=1S/C24H27ClN6O3/c1-34-21-6-5-16(10-19(21)25)12-28-20-11-23(31-9-2-4-17(31)15-32)29-13-18(20)24(33)30-14-22-26-7-3-8-27-22/h3,5-8,10-11,13,17,32H,2,4,9,12,14-15H2,1H3,(H,28,29)(H,30,33)