1-morpholin-4-yl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-morpholino-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(4-morpholinyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-morpholin-4-yl-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-morpholino-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C12H20N4O2S MolecularWeight: 284.3778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SC(C)C(=O)N2CCOCC2

Isomeric SMILES

CCCC1=NC(=NN1)SC(C)C(=O)N2CCOCC2

InChI

InChI=1S/C12H20N4O2S/c1-3-4-10-13-12(15-14-10)19-9(2)11(17)16-5-7-18-8-6-16/h9H,3-8H2,1-2H3,(H,13,14,15)