5-[[(3,4-dimethoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine

Systemtic Name: 5-[[(3,4-dimethoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine Openeye Name: 5-[[(3,4-dimethoxyphenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]methyl]-N-methyl-pyrimidin-2-amine CAS Name: 5-[[(3,4-dimethoxyphenyl)methyl-(2-oxolanylmethyl)amino]methyl]-N-methyl-2-pyrimidinamine IUPAC Name: 5-[[(3,4-dimethoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]-N-methylpyrimidin-2-amine Traditional Name: [2-(methylamino)pyrimidin-5-yl]methyl-(tetrahydrofurfuryl)-veratryl-amine Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=N1)CN(CC2CCCO2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CNC1=NC=C(C=N1)CN(CC2CCCO2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H28N4O3/c1-21-20-22-10-16(11-23-20)13-24(14-17-5-4-8-27-17)12-15-6-7-18(25-2)19(9-15)26-3/h6-7,9-11,17H,4-5,8,12-14H2,1-3H3,(H,21,22,23)