4-(7-methoxy-1,3-benzodioxol-5-yl)-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-phenyl-pyrimidin-2-amine Openeye Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-phenyl-pyrimidin-2-amine CAS Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-phenyl-2-pyrimidinamine IUPAC Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-N-phenylpyrimidin-2-amine Traditional Name: [4-(7-methoxy-1,3-benzodioxol-5-yl)pyrimidin-2-yl]-phenyl-amine Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3=NC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C3=NC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C18H15N3O3/c1-22-15-9-12(10-16-17(15)24-11-23-16)14-7-8-19-18(21-14)20-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,20,21)