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

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-pyridin-3-yloxy-pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(3-pyridyloxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(3-pyridinyloxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-pyridin-3-yloxypyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3-pyridyloxy)pyrimidin-4-yl]-piperonyl-amine Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O3/c18-15-16(20-7-11-3-4-13-14(6-11)24-10-23-13)21-9-22-17(15)25-12-2-1-5-19-8-12/h1-6,8-9H,7,10,18H2,(H,20,21,22)