6-[3,5-bis(trifluoromethyl)phenoxy]quinazoline-2,4-diamine

Systemtic Name: 6-[3,5-bis(trifluoromethyl)phenoxy]quinazoline-2,4-diamine Openeye Name: 6-[3,5-bis(trifluoromethyl)phenoxy]quinazoline-2,4-diamine CAS Name: 6-[3,5-bis(trifluoromethyl)phenoxy]quinazoline-2,4-diamine IUPAC Name: 6-[3,5-bis(trifluoromethyl)phenoxy]quinazoline-2,4-diamine Traditional Name: [2-amino-6-[3,5-bis(trifluoromethyl)phenoxy]quinazolin-4-yl]amine Formula: C16H10F6N4O MolecularWeight: 388.267219

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=NC(=N2)N)N

Isomeric SMILES

C1=CC2=C(C=C1OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=NC(=N2)N)N

InChI

InChI=1S/C16H10F6N4O/c17-15(18,19)7-3-8(16(20,21)22)5-10(4-7)27-9-1-2-12-11(6-9)13(23)26-14(24)25-12/h1-6H,(H4,23,24,25,26)