N-[3-[(5-bromanyl-4-prop-2-ynoxy-pyrimidin-2-yl)amino]phenyl]-2-(2-hydroxyphenyl)ethanamide

Systemtic Name: N-[3-[(5-bromanyl-4-prop-2-ynoxy-pyrimidin-2-yl)amino]phenyl]-2-(2-hydroxyphenyl)ethanamide Openeye Name: N-[3-[(5-bromo-4-prop-2-ynoxy-pyrimidin-2-yl)amino]phenyl]-2-(2-hydroxyphenyl)acetamide CAS Name: N-[3-[(5-bromo-4-prop-2-ynoxy-2-pyrimidinyl)amino]phenyl]-2-(2-hydroxyphenyl)acetamide IUPAC Name: N-[3-[(5-bromo-4-prop-2-ynoxypyrimidin-2-yl)amino]phenyl]-2-(2-hydroxyphenyl)acetamide Traditional Name: N-[3-[(5-bromo-4-propargyloxy-pyrimidin-2-yl)amino]phenyl]-2-(2-hydroxyphenyl)acetamide Formula: C21H17BrN4O3 MolecularWeight: 453.28868

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=NC(=NC=C1Br)NC2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3O

Isomeric SMILES

C#CCOC1=NC(=NC=C1Br)NC2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3O

InChI

InChI=1S/C21H17BrN4O3/c1-2-10-29-20-17(22)13-23-21(26-20)25-16-8-5-7-15(12-16)24-19(28)11-14-6-3-4-9-18(14)27/h1,3-9,12-13,27H,10-11H2,(H,24,28)(H,23,25,26)