N4-(1,3-benzodioxol-5-ylmethyl)-6-naphthalen-2-yloxy-pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-naphthalen-2-yloxy-pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(2-naphthyloxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(2-naphthalenyloxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-naphthalen-2-yloxypyrimidine-4,5-diamine Traditional Name: [5-amino-6-(2-naphthoxy)pyrimidin-4-yl]-piperonyl-amine Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)N

InChI

InChI=1S/C22H18N4O3/c23-20-21(24-11-14-5-8-18-19(9-14)28-13-27-18)25-12-26-22(20)29-17-7-6-15-3-1-2-4-16(15)10-17/h1-10,12H,11,13,23H2,(H,24,25,26)