N-(3-chloranyl-4-fluoranyl-phenyl)-6-ethynyl-quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-ethynyl-quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-ethynyl-quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-ethynyl-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-ethynylquinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-(6-ethynylquinazolin-4-yl)amine Formula: C16H9ClFN3 MolecularWeight: 297.714163

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C#CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H9ClFN3/c1-2-10-3-6-15-12(7-10)16(20-9-19-15)21-11-4-5-14(18)13(17)8-11/h1,3-9H,(H,19,20,21)