1-morpholin-4-yl-5-(7H-purin-6-ylsulfanyl)pentan-1-one

Systemtic Name: 1-morpholin-4-yl-5-(7H-purin-6-ylsulfanyl)pentan-1-one Openeye Name: 1-morpholino-5-(7H-purin-6-ylsulfanyl)pentan-1-one CAS Name: 1-(4-morpholinyl)-5-(7H-purin-6-ylthio)-1-pentanone IUPAC Name: 1-morpholin-4-yl-5-(7H-purin-6-ylsulfanyl)pentan-1-one Traditional Name: 1-morpholino-5-(7H-purin-6-ylthio)pentan-1-one Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCCCSC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1COCCN1C(=O)CCCCSC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C14H19N5O2S/c20-11(19-4-6-21-7-5-19)3-1-2-8-22-14-12-13(16-9-15-12)17-10-18-14/h9-10H,1-8H2,(H,15,16,17,18)