N-[2,5-bis(trifluoromethyl)phenyl]-6,7-dimethyl-quinazolin-4-amine

Systemtic Name: N-[2,5-bis(trifluoromethyl)phenyl]-6,7-dimethyl-quinazolin-4-amine Openeye Name: N-[2,5-bis(trifluoromethyl)phenyl]-6,7-dimethyl-quinazolin-4-amine CAS Name: N-[2,5-bis(trifluoromethyl)phenyl]-6,7-dimethyl-4-quinazolinamine IUPAC Name: N-[2,5-bis(trifluoromethyl)phenyl]-6,7-dimethylquinazolin-4-amine Traditional Name: [2,5-bis(trifluoromethyl)phenyl]-(6,7-dimethylquinazolin-4-yl)amine Formula: C18H13F6N3 MolecularWeight: 385.306339

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C18H13F6N3/c1-9-5-12-14(6-10(9)2)25-8-26-16(12)27-15-7-11(17(19,20)21)3-4-13(15)18(22,23)24/h3-8H,1-2H3,(H,25,26,27)