9-methyl-N-phenethyl-8-thiophen-2-yl-6-(trifluoromethyl)purin-2-amine

Systemtic Name: 9-methyl-N-phenethyl-8-thiophen-2-yl-6-(trifluoromethyl)purin-2-amine Openeye Name: 9-methyl-N-phenethyl-8-(2-thienyl)-6-(trifluoromethyl)purin-2-amine CAS Name: 9-methyl-N-phenethyl-8-thiophen-2-yl-6-(trifluoromethyl)-2-purinamine IUPAC Name: 9-methyl-N-phenethyl-8-thiophen-2-yl-6-(trifluoromethyl)purin-2-amine Traditional Name: [9-methyl-8-(2-thienyl)-6-(trifluoromethyl)purin-2-yl]-phenethyl-amine Formula: C19H16F3N5S MolecularWeight: 403.42405

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C(N=C(N=C21)NCCC3=CC=CC=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

CN1C(=NC2=C(N=C(N=C21)NCCC3=CC=CC=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C19H16F3N5S/c1-27-16(13-8-5-11-28-13)24-14-15(19(20,21)22)25-18(26-17(14)27)23-10-9-12-6-3-2-4-7-12/h2-8,11H,9-10H2,1H3,(H,23,25,26)