4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2,1-benzoxazol-5-yl]pyrimidin-2-amine

Systemtic Name: 4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2,1-benzoxazol-5-yl]pyrimidin-2-amine Openeye Name: 4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2,1-benzoxazol-5-yl]pyrimidin-2-amine CAS Name: 4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2,1-benzoxazol-5-yl]-2-pyrimidinamine IUPAC Name: 4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2,1-benzoxazol-5-yl]pyrimidin-2-amine Traditional Name: [4-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]anthranil-5-yl]pyrimidin-2-yl]amine Formula: C25H18N4O3 MolecularWeight: 422.43542

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CC(=CC=C3)C4=C5C=C(C=CC5=NO4)C6=NC(=NC=C6)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CC(=CC=C3)C4=C5C=C(C=CC5=NO4)C6=NC(=NC=C6)N

InChI

InChI=1S/C25H18N4O3/c26-25-27-9-8-20(28-25)17-4-6-21-19(13-17)24(32-29-21)18-3-1-2-15(12-18)16-5-7-22-23(14-16)31-11-10-30-22/h1-9,12-14H,10-11H2,(H2,26,27,28)