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

Systemtic Name: 1-(1-benzofuran-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Openeye Name: 1-(benzofuran-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone CAS Name: 1-(2-benzofuranyl)-2-(7H-purin-6-ylthio)ethanone IUPAC Name: 1-(1-benzofuran-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Traditional Name: 1-(benzofuran-2-yl)-2-(7H-purin-6-ylthio)ethanone Formula: C15H10N4O2S MolecularWeight: 310.3305

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C15H10N4O2S/c20-10(12-5-9-3-1-2-4-11(9)21-12)6-22-15-13-14(17-7-16-13)18-8-19-15/h1-5,7-8H,6H2,(H,16,17,18,19)