2-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3,3-dimethoxy-propanethioamide

Systemtic Name: 2-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3,3-dimethoxy-propanethioamide Openeye Name: 2-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-3,3-dimethoxy-propanethioamide CAS Name: 2-[5-amino-3-(4-morpholinyl)-1,2,4-triazol-1-yl]-3,3-dimethoxypropanethioamide IUPAC Name: 2-(5-amino-3-morpholin-4-yl-1,2,4-triazol-1-yl)-3,3-dimethoxypropanethioamide Traditional Name: 2-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-3,3-dimethoxy-thiopropionamide Formula: C11H20N6O3S MolecularWeight: 316.3799

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(C(=S)N)N1C(=NC(=N1)N2CCOCC2)N)OC

Isomeric SMILES

COC(C(C(=S)N)N1C(=NC(=N1)N2CCOCC2)N)OC

InChI

InChI=1S/C11H20N6O3S/c1-18-9(19-2)7(8(12)21)17-10(13)14-11(15-17)16-3-5-20-6-4-16/h7,9H,3-6H2,1-2H3,(H2,12,21)(H2,13,14,15)