N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-(5-acetyl-4-methyl-2-thiazolyl)-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-2-(7H-purin-6-ylthio)acetamide Formula: C13H12N6O2S2 MolecularWeight: 348.40338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=NC=NC3=C2NC=N3)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=NC=NC3=C2NC=N3)C(=O)C

InChI

InChI=1S/C13H12N6O2S2/c1-6-10(7(2)20)23-13(18-6)19-8(21)3-22-12-9-11(15-4-14-9)16-5-17-12/h4-5H,3H2,1-2H3,(H,18,19,21)(H,14,15,16,17)