2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]pyrimidin-4-amine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]pyrimidin-4-amine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]pyrimidin-4-amine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]-4-pyrimidinamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]pyrimidin-4-amine Traditional Name: [2-(1,3-benzodioxol-5-yl)pyrimidin-4-yl]-(2,4-dimethoxybenzyl)amine Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC(=NC=C2)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC(=NC=C2)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H19N3O4/c1-24-15-5-3-14(17(10-15)25-2)11-22-19-7-8-21-20(23-19)13-4-6-16-18(9-13)27-12-26-16/h3-10H,11-12H2,1-2H3,(H,21,22,23)