N-(3-chloranyl-4-fluoranyl-phenyl)-6-(2-thiophen-2-ylethynyl)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-(2-thiophen-2-ylethynyl)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-[2-(2-thienyl)ethynyl]quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-(2-thiophen-2-ylethynyl)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-(2-thiophen-2-ylethynyl)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6-[2-(2-thienyl)ethynyl]quinazolin-4-yl]amine Formula: C20H11ClFN3S MolecularWeight: 379.837843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CSC(=C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H11ClFN3S/c21-17-11-14(5-7-18(17)22)25-20-16-10-13(3-6-15-2-1-9-26-15)4-8-19(16)23-12-24-20/h1-2,4-5,7-12H,(H,23,24,25)