N-[2,5-bis(trifluoromethyl)phenyl]-7H-purin-6-amine

Systemtic Name: N-[2,5-bis(trifluoromethyl)phenyl]-7H-purin-6-amine Openeye Name: N-[2,5-bis(trifluoromethyl)phenyl]-7H-purin-6-amine CAS Name: N-[2,5-bis(trifluoromethyl)phenyl]-7H-purin-6-amine IUPAC Name: N-[2,5-bis(trifluoromethyl)phenyl]-7H-purin-6-amine Traditional Name: [2,5-bis(trifluoromethyl)phenyl]-(7H-purin-6-yl)amine Formula: C13H7F6N5 MolecularWeight: 347.218599

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)NC2=NC=NC3=C2NC=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)NC2=NC=NC3=C2NC=N3)C(F)(F)F

InChI

InChI=1S/C13H7F6N5/c14-12(15,16)6-1-2-7(13(17,18)19)8(3-6)24-11-9-10(21-4-20-9)22-5-23-11/h1-5H,(H2,20,21,22,23,24)