N6-(1,3-benzodioxol-5-ylmethyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1,3-benzodioxol-5-ylmethyl)-4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-4-yl]-piperonyl-amine Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=C(C(=NC=N3)NCC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=C(C(=NC=N3)NCC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C20H19N5O4/c21-18-19(22-9-12-1-3-15-16(7-12)29-11-28-15)23-10-24-20(18)25-13-2-4-14-17(8-13)27-6-5-26-14/h1-4,7-8,10H,5-6,9,11,21H2,(H2,22,23,24,25)