N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-2-(7H-purin-6-ylthio)acetamide Formula: C17H14N6O2S2 MolecularWeight: 398.46206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H14N6O2S2/c1-25-11-4-2-10(3-5-11)12-6-27-17(22-12)23-13(24)7-26-16-14-15(19-8-18-14)20-9-21-16/h2-6,8-9H,7H2,1H3,(H,22,23,24)(H,18,19,20,21)