6-(1,3-benzodioxol-5-yl)-2-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-phenyl-pyrimidin-4-amine Openeye Name: 6-(1,3-benzodioxol-5-yl)-2-phenyl-pyrimidin-4-amine CAS Name: 6-(1,3-benzodioxol-5-yl)-2-phenyl-4-pyrimidinamine IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2-phenylpyrimidin-4-amine Traditional Name: [6-(1,3-benzodioxol-5-yl)-2-phenyl-pyrimidin-4-yl]amine Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC(=N3)C4=CC=CC=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC(=N3)C4=CC=CC=C4)N

InChI

InChI=1S/C17H13N3O2/c18-16-9-13(12-6-7-14-15(8-12)22-10-21-14)19-17(20-16)11-4-2-1-3-5-11/h1-9H,10H2,(H2,18,19,20)