N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N6-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N6-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N6-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine CAS Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N6-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(5-chloro-1,3-benzodioxol-4-yl)-6-N-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[6-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amine Formula: C20H19ClN4O5 MolecularWeight: 430.84166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=CC(=NC=N2)NC3=C(C=CC4=C3OCO4)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=CC(=NC=N2)NC3=C(C=CC4=C3OCO4)Cl

InChI

InChI=1S/C20H19ClN4O5/c1-26-14-6-11(7-15(27-2)19(14)28-3)24-16-8-17(23-9-22-16)25-18-12(21)4-5-13-20(18)30-10-29-13/h4-9H,10H2,1-3H3,(H2,22,23,24,25)