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

Systemtic Name: 6-(benzimidazol-1-yl)-N4-(1,3-benzodioxol-5-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-(benzimidazol-1-yl)-N4-(1,3-benzodioxol-5-ylmethyl)pyrimidine-4,5-diamine CAS Name: 6-(1-benzimidazolyl)-N4-(1,3-benzodioxol-5-ylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(benzimidazol-1-yl)-4-N-(1,3-benzodioxol-5-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(benzimidazol-1-yl)pyrimidin-4-yl]-piperonyl-amine Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3N)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3N)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C19H16N6O2/c20-17-18(21-8-12-5-6-15-16(7-12)27-11-26-15)22-9-23-19(17)25-10-24-13-3-1-2-4-14(13)25/h1-7,9-10H,8,11,20H2,(H,21,22,23)