2-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3-oxidanyl-pentanethioamide

Systemtic Name: 2-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3-oxidanyl-pentanethioamide Openeye Name: 2-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-3-hydroxy-pentanethioamide CAS Name: 2-[5-amino-3-(4-morpholinyl)-1,2,4-triazol-1-yl]-3-hydroxypentanethioamide IUPAC Name: 2-(5-amino-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3-hydroxypentanethioamide Traditional Name: 2-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-3-hydroxy-thiovaleramide Formula: C11H20N6O2S MolecularWeight: 300.3805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=S)N)N1C(=NC(=N1)N2CCOCC2)N)O

Isomeric SMILES

CCC(C(C(=S)N)N1C(=NC(=N1)N2CCOCC2)N)O

InChI

InChI=1S/C11H20N6O2S/c1-2-7(18)8(9(12)20)17-10(13)14-11(15-17)16-3-5-19-6-4-16/h7-8,18H,2-6H2,1H3,(H2,12,20)(H2,13,14,15)