1-morpholin-4-yl-2-(7H-purin-6-ylsulfanyl)ethanone

Systemtic Name: 1-morpholin-4-yl-2-(7H-purin-6-ylsulfanyl)ethanone Openeye Name: 1-morpholino-2-(7H-purin-6-ylsulfanyl)ethanone CAS Name: 1-(4-morpholinyl)-2-(7H-purin-6-ylthio)ethanone IUPAC Name: 1-morpholin-4-yl-2-(7H-purin-6-ylsulfanyl)ethanone Traditional Name: 1-morpholino-2-(7H-purin-6-ylthio)ethanone Formula: C11H13N5O2S MolecularWeight: 279.31822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C11H13N5O2S/c17-8(16-1-3-18-4-2-16)5-19-11-9-10(13-6-12-9)14-7-15-11/h6-7H,1-5H2,(H,12,13,14,15)