6-[[[3,5-bis(trifluoromethyl)phenyl]-methyl-amino]methyl]quinazoline-2,4-diamine

Systemtic Name: 6-[[[3,5-bis(trifluoromethyl)phenyl]-methyl-amino]methyl]quinazoline-2,4-diamine Openeye Name: 6-[[N-methyl-3,5-bis(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine CAS Name: 6-[[N-methyl-3,5-bis(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine IUPAC Name: 6-[[N-methyl-3,5-bis(trifluoromethyl)anilino]methyl]quinazoline-2,4-diamine Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-[(2,4-diaminoquinazolin-6-yl)methyl]-methyl-amine Formula: C18H15F6N5 MolecularWeight: 415.335619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F6N5/c1-29(8-9-2-3-14-13(4-9)15(25)28-16(26)27-14)12-6-10(17(19,20)21)5-11(7-12)18(22,23)24/h2-7H,8H2,1H3,(H4,25,26,27,28)