N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-5-ethynyl-pyrimidin-4-amine

Systemtic Name: N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-5-ethynyl-pyrimidin-4-amine Openeye Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-5-ethynyl-pyrimidin-4-amine CAS Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-5-ethynyl-4-pyrimidinamine IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-5-ethynylpyrimidin-4-amine Traditional Name: [3-chloro-4-(3-fluorobenzyl)oxy-phenyl]-(5-ethynylpyrimidin-4-yl)amine Formula: C19H13ClFN3O MolecularWeight: 353.777423

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN=CN=C1NC2=CC(=C(C=C2)OCC3=CC(=CC=C3)F)Cl

Isomeric SMILES

C#CC1=CN=CN=C1NC2=CC(=C(C=C2)OCC3=CC(=CC=C3)F)Cl

InChI

InChI=1S/C19H13ClFN3O/c1-2-14-10-22-12-23-19(14)24-16-6-7-18(17(20)9-16)25-11-13-4-3-5-15(21)8-13/h1,3-10,12H,11H2,(H,22,23,24)