N4-(1,3-benzodioxol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Traditional Name: 1,3-benzodioxol-5-yl-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amine Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O5/c1-25-16-9-13(10-17(26-2)19(16)27-3)23-20-21-7-6-18(24-20)22-12-4-5-14-15(8-12)29-11-28-14/h4-10H,11H2,1-3H3,(H2,21,22,23,24)