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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methylmorpholin-4-yl)ethanone Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methylmorpholin-4-yl)ethanone CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-methyl-4-morpholinyl)ethanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methylmorpholin-4-yl)ethanone Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-methylmorpholino)ethanone Formula: C9H15N5O2S MolecularWeight: 257.3127

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CC1CN(CCO1)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C9H15N5O2S/c1-6-4-14(2-3-16-6)7(15)5-17-9-11-8(10)12-13-9/h6H,2-5H2,1H3,(H3,10,11,12,13)