N-(3-ethynylphenyl)-6-[4-(trifluoromethyl)phenyl]quinazolin-4-amine

Systemtic Name: N-(3-ethynylphenyl)-6-[4-(trifluoromethyl)phenyl]quinazolin-4-amine Openeye Name: N-(3-ethynylphenyl)-6-[4-(trifluoromethyl)phenyl]quinazolin-4-amine CAS Name: N-(3-ethynylphenyl)-6-[4-(trifluoromethyl)phenyl]-4-quinazolinamine IUPAC Name: N-(3-ethynylphenyl)-6-[4-(trifluoromethyl)phenyl]quinazolin-4-amine Traditional Name: (3-ethynylphenyl)-[6-[4-(trifluoromethyl)phenyl]quinazolin-4-yl]amine Formula: C23H14F3N3 MolecularWeight: 389.37257

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H14F3N3/c1-2-15-4-3-5-19(12-15)29-22-20-13-17(8-11-21(20)27-14-28-22)16-6-9-18(10-7-16)23(24,25)26/h1,3-14H,(H,27,28,29)