N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-pyridin-3-yl-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-pyridin-3-yl-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-(3-pyridyl)pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-imidazolyl)-5-(3-pyridinyl)-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-5-pyridin-3-ylpyrimidin-4-amine Traditional Name: [2-imidazol-1-yl-5-(3-pyridyl)pyrimidin-4-yl]-piperonyl-amine Formula: C20H16N6O2 MolecularWeight: 372.38004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC=C3C4=CN=CC=C4)N5C=CN=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC=C3C4=CN=CC=C4)N5C=CN=C5

InChI

InChI=1S/C20H16N6O2/c1-2-15(10-21-5-1)16-11-24-20(26-7-6-22-12-26)25-19(16)23-9-14-3-4-17-18(8-14)28-13-27-17/h1-8,10-12H,9,13H2,(H,23,24,25)