N-(4-tert-butyl-1,3-thiazol-2-yl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]sulfanyl]ethanamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]sulfanyl]acetamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]thio]acetamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]sulfanyl]acetamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-2-[[2-(2-fluorophenyl)-7H-purin-6-yl]thio]acetamide Formula: C20H19FN6OS2 MolecularWeight: 442.532863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC(=NC3=C2NC=N3)C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC(=NC3=C2NC=N3)C4=CC=CC=C4F

InChI

InChI=1S/C20H19FN6OS2/c1-20(2,3)13-8-30-19(24-13)25-14(28)9-29-18-15-17(23-10-22-15)26-16(27-18)11-6-4-5-7-12(11)21/h4-8,10H,9H2,1-3H3,(H,24,25,28)(H,22,23,26,27)