6-[[ethyl-[3-(trifluoromethyl)phenyl]amino]methyl]quinazoline-2,4-diamine

Systemtic Name: 6-[[ethyl-[3-(trifluoromethyl)phenyl]amino]methyl]quinazoline-2,4-diamine Openeye Name: 6-[[N-ethyl-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine CAS Name: 6-[[N-ethyl-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine IUPAC Name: 6-[[N-ethyl-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine Traditional Name: (2,4-diaminoquinazolin-6-yl)methyl-ethyl-[3-(trifluoromethyl)phenyl]amine Formula: C18H18F3N5 MolecularWeight: 361.36423

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)N=C(N=C2N)N)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)N=C(N=C2N)N)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N5/c1-2-26(13-5-3-4-12(9-13)18(19,20)21)10-11-6-7-15-14(8-11)16(22)25-17(23)24-15/h3-9H,2,10H2,1H3,(H4,22,23,24,25)