1-(5-chloranylthiophen-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Openeye Name: 1-(5-chloro-2-thienyl)-2-(7H-purin-6-ylsulfanyl)ethanone CAS Name: 1-(5-chloro-2-thiophenyl)-2-(7H-purin-6-ylthio)ethanone IUPAC Name: 1-(5-chlorothiophen-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Traditional Name: 1-(5-chloro-2-thienyl)-2-(7H-purin-6-ylthio)ethanone Formula: C11H7ClN4OS2 MolecularWeight: 310.78248

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)C(=O)CSC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1=C(SC(=C1)Cl)C(=O)CSC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C11H7ClN4OS2/c12-8-2-1-7(19-8)6(17)3-18-11-9-10(14-4-13-9)15-5-16-11/h1-2,4-5H,3H2,(H,13,14,15,16)