5-bromanyl-N-[3-(oxiran-2-ylmethoxy)phenyl]-4-prop-2-ynoxy-pyrimidin-2-amine

Systemtic Name: 5-bromanyl-N-[3-(oxiran-2-ylmethoxy)phenyl]-4-prop-2-ynoxy-pyrimidin-2-amine Openeye Name: 5-bromo-N-[3-(oxiran-2-ylmethoxy)phenyl]-4-prop-2-ynoxy-pyrimidin-2-amine CAS Name: 5-bromo-N-[3-(2-oxiranylmethoxy)phenyl]-4-prop-2-ynoxy-2-pyrimidinamine IUPAC Name: 5-bromo-N-[3-(oxiran-2-ylmethoxy)phenyl]-4-prop-2-ynoxypyrimidin-2-amine Traditional Name: (5-bromo-4-propargyloxy-pyrimidin-2-yl)-(3-glycidoxyphenyl)amine Formula: C16H14BrN3O3 MolecularWeight: 376.20466

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=NC(=NC=C1Br)NC2=CC(=CC=C2)OCC3CO3

Isomeric SMILES

C#CCOC1=NC(=NC=C1Br)NC2=CC(=CC=C2)OCC3CO3

InChI

InChI=1S/C16H14BrN3O3/c1-2-6-21-15-14(17)8-18-16(20-15)19-11-4-3-5-12(7-11)22-9-13-10-23-13/h1,3-5,7-8,13H,6,9-10H2,(H,18,19,20)