2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[2-(trifluoromethyl)-4-quinazolinyl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[2-(trifluoromethyl)quinazolin-4-yl]thio]methyl]quinazolin-4-yl]amine Formula: C18H12F3N5S MolecularWeight: 387.38159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F)N

InChI

InChI=1S/C18H12F3N5S/c19-18(20,21)17-24-13-8-4-2-6-11(13)16(26-17)27-9-14-23-12-7-3-1-5-10(12)15(22)25-14/h1-8H,9H2,(H2,22,23,25)