N4-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)pyrimidine-4,6-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)pyrimidine-4,6-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)pyrimidine-4,6-diamine Traditional Name: [6-amino-5-(piperonyliminomethyl)pyrimidin-4-yl]-piperonyl-amine Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3C=NCC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3C=NCC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C21H19N5O4/c22-20-15(9-23-7-13-1-3-16-18(5-13)29-11-27-16)21(26-10-25-20)24-8-14-2-4-17-19(6-14)30-12-28-17/h1-6,9-10H,7-8,11-12H2,(H3,22,24,25,26)