2-(chloromethyl)-N-phenethyl-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: 2-(chloromethyl)-N-phenethyl-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: 2-(chloromethyl)-N-phenethyl-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: 2-(chloromethyl)-N-phenethyl-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: 2-(chloromethyl)-N-phenethyl-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: [2-(chloromethyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]-phenethyl-amine Formula: C23H18ClF3N4 MolecularWeight: 442.86403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F)CCl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F)CCl

InChI

InChI=1S/C23H18ClF3N4/c24-14-20-30-19-13-16(21-18(23(25,26)27)7-4-11-28-21)8-9-17(19)22(31-20)29-12-10-15-5-2-1-3-6-15/h1-9,11,13H,10,12,14H2,(H,29,30,31)