2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholino-ethanone CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-1-morpholino-ethanone Formula: C12H21N5O2S MolecularWeight: 299.39244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)N2CCOCC2

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)N2CCOCC2

InChI

InChI=1S/C12H21N5O2S/c1-2-3-4-10-14-15-12(17(10)13)20-9-11(18)16-5-7-19-8-6-16/h2-9,13H2,1H3