N-(3-chlorophenyl)-8-(trifluoromethyl)purin-9-id-6-amine

Systemtic Name: N-(3-chlorophenyl)-8-(trifluoromethyl)purin-9-id-6-amine Openeye Name: N-(3-chlorophenyl)-8-(trifluoromethyl)purin-9-id-6-amine CAS Name: N-(3-chlorophenyl)-8-(trifluoromethyl)-6-purin-9-idamine IUPAC Name: N-(3-chlorophenyl)-8-(trifluoromethyl)purin-9-id-6-amine Traditional Name: (3-chlorophenyl)-[8-(trifluoromethyl)purin-9-id-6-yl]amine Formula: C12H6ClF3N5- MolecularWeight: 312.65775

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2N=C([N-]3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2N=C([N-]3)C(F)(F)F

InChI

InChI=1S/C12H6ClF3N5/c13-6-2-1-3-7(4-6)19-9-8-10(18-5-17-9)21-11(20-8)12(14,15)16/h1-5H,(H-,17,18,19,20,21)/q-1