N-methyl-9-[3-(methylamino)phenyl]-2-(trifluoromethyl)purin-6-amine

Systemtic Name: N-methyl-9-[3-(methylamino)phenyl]-2-(trifluoromethyl)purin-6-amine Openeye Name: N-methyl-9-[3-(methylamino)phenyl]-2-(trifluoromethyl)purin-6-amine CAS Name: N-methyl-9-[3-(methylamino)phenyl]-2-(trifluoromethyl)-6-purinamine IUPAC Name: N-methyl-9-[3-(methylamino)phenyl]-2-(trifluoromethyl)purin-6-amine Traditional Name: methyl-[9-[3-(methylamino)phenyl]-2-(trifluoromethyl)purin-6-yl]amine Formula: C14H13F3N6 MolecularWeight: 322.28843

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC(=C1)N2C=NC3=C2N=C(N=C3NC)C(F)(F)F

Isomeric SMILES

CNC1=CC=CC(=C1)N2C=NC3=C2N=C(N=C3NC)C(F)(F)F

InChI

InChI=1S/C14H13F3N6/c1-18-8-4-3-5-9(6-8)23-7-20-10-11(19-2)21-13(14(15,16)17)22-12(10)23/h3-7,18H,1-2H3,(H,19,21,22)