4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-phenoxyphenyl)pyrimidin-2-amine

Systemtic Name: 4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-phenoxyphenyl)pyrimidin-2-amine Openeye Name: 4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-phenoxyphenyl)pyrimidin-2-amine CAS Name: 4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-phenoxyphenyl)-2-pyrimidinamine IUPAC Name: 4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-phenoxyphenyl)pyrimidin-2-amine Traditional Name: [4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]-(3-phenoxyphenyl)amine Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1OCCO2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC2=C1OCCO2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H21N3O4/c1-29-23-20(10-11-22-24(23)31-15-14-30-22)21-12-13-26-25(28-21)27-17-6-5-9-19(16-17)32-18-7-3-2-4-8-18/h2-13,16H,14-15H2,1H3,(H,26,27,28)