N-cyclopropyl-9-thiophen-3-yl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: N-cyclopropyl-9-thiophen-3-yl-2-(trifluoromethyl)purin-6-amine Openeye Name: N-cyclopropyl-9-(3-thienyl)-2-(trifluoromethyl)purin-6-amine CAS Name: N-cyclopropyl-9-(3-thiophenyl)-2-(trifluoromethyl)-6-purinamine IUPAC Name: N-cyclopropyl-9-thiophen-3-yl-2-(trifluoromethyl)purin-6-amine Traditional Name: cyclopropyl-[9-(3-thienyl)-2-(trifluoromethyl)purin-6-yl]amine Formula: C13H10F3N5S MolecularWeight: 325.31221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2N=CN3C4=CSC=C4)C(F)(F)F

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3C4=CSC=C4)C(F)(F)F

InChI

InChI=1S/C13H10F3N5S/c14-13(15,16)12-19-10(18-7-1-2-7)9-11(20-12)21(6-17-9)8-3-4-22-5-8/h3-7H,1-2H2,(H,18,19,20)