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

Systemtic Name: 6-[[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]methyl]quinazoline-2,4-diamine Openeye Name: 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine CAS Name: 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine IUPAC Name: 6-[[4-chloro-3-(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine Traditional Name: [4-chloro-3-(trifluoromethyl)phenyl]-[(2,4-diaminoquinazolin-6-yl)methyl]amine Formula: C16H13ClF3N5 MolecularWeight: 367.75613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CNC3=CC(=C(C=C3)Cl)C(F)(F)F)C(=NC(=N2)N)N

Isomeric SMILES

C1=CC2=C(C=C1CNC3=CC(=C(C=C3)Cl)C(F)(F)F)C(=NC(=N2)N)N

InChI

InChI=1S/C16H13ClF3N5/c17-12-3-2-9(6-11(12)16(18,19)20)23-7-8-1-4-13-10(5-8)14(21)25-15(22)24-13/h1-6,23H,7H2,(H4,21,22,24,25)