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

Systemtic Name: N-[3-[(5-bromanyl-4-prop-2-ynoxy-pyrimidin-2-yl)amino]phenyl]-2-oxidanyl-2-phenyl-ethanamide Openeye Name: N-[3-[(5-bromo-4-prop-2-ynoxy-pyrimidin-2-yl)amino]phenyl]-2-hydroxy-2-phenyl-acetamide CAS Name: N-[3-[(5-bromo-4-prop-2-ynoxy-2-pyrimidinyl)amino]phenyl]-2-hydroxy-2-phenylacetamide IUPAC Name: N-[3-[(5-bromo-4-prop-2-ynoxypyrimidin-2-yl)amino]phenyl]-2-hydroxy-2-phenylacetamide Traditional Name: N-[3-[(5-bromo-4-propargyloxy-pyrimidin-2-yl)amino]phenyl]-2-hydroxy-2-phenyl-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)C(C3=CC=CC=C3)O

Isomeric SMILES

C#CCOC1=NC(=NC=C1Br)NC2=CC(=CC=C2)NC(=O)C(C3=CC=CC=C3)O

InChI

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