5-[[1,3-benzodioxol-5-ylmethyl(pyridin-4-ylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine

Systemtic Name: 5-[[1,3-benzodioxol-5-ylmethyl(pyridin-4-ylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine Openeye Name: 5-[[1,3-benzodioxol-5-ylmethyl(4-pyridylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine CAS Name: 5-[[1,3-benzodioxol-5-ylmethyl(pyridin-4-ylmethyl)amino]methyl]-N-methyl-2-pyrimidinamine IUPAC Name: 5-[[1,3-benzodioxol-5-ylmethyl(pyridin-4-ylmethyl)amino]methyl]-N-methylpyrimidin-2-amine Traditional Name: [2-(methylamino)pyrimidin-5-yl]methyl-piperonyl-(4-pyridylmethyl)amine Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=N1)CN(CC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CNC1=NC=C(C=N1)CN(CC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N5O2/c1-21-20-23-9-17(10-24-20)13-25(11-15-4-6-22-7-5-15)12-16-2-3-18-19(8-16)27-14-26-18/h2-10H,11-14H2,1H3,(H,21,23,24)