2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-tert-butylthiazol-2-yl)acetamide CAS Name: 2-[(6-amino-7H-purin-8-yl)thio]-N-(4-tert-butyl-2-thiazolyl)acetamide IUPAC Name: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(6-amino-7H-purin-8-yl)thio]-N-(4-tert-butylthiazol-2-yl)acetamide Formula: C14H17N7OS2 MolecularWeight: 363.46108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC3=C(N2)C(=NC=N3)N

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CSC2=NC3=C(N2)C(=NC=N3)N

InChI

InChI=1S/C14H17N7OS2/c1-14(2,3)7-4-23-12(18-7)19-8(22)5-24-13-20-9-10(15)16-6-17-11(9)21-13/h4,6H,5H2,1-3H3,(H,18,19,22)(H3,15,16,17,20,21)