(E)-3-[2-(methylamino)ethanoylamino]-4-methylsulfanyl-2-oxidanyl-but-1-ene-1-diazonium

Systemtic Name: (E)-3-[2-(methylamino)ethanoylamino]-4-methylsulfanyl-2-oxidanyl-but-1-ene-1-diazonium Openeye Name: (E)-2-hydroxy-3-[[2-(methylamino)acetyl]amino]-4-methylsulfanyl-but-1-ene-1-diazonium CAS Name: (E)-2-hydroxy-3-[[2-(methylamino)-1-oxoethyl]amino]-4-(methylthio)-1-butene-1-diazonium IUPAC Name: (E)-2-hydroxy-3-[[2-(methylamino)acetyl]amino]-4-methylsulfanylbut-1-ene-1-diazonium Traditional Name: (E)-2-hydroxy-4-(methylthio)-3-(sarcosylamino)but-1-ene-1-diazonium Formula: C8H15N4O2S+ MolecularWeight: 231.2953

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(=O)NC(CSC)C(=C[N+]#N)O

Isomeric SMILES

CNCC(=O)NC(CSC)/C(=C\[N+]#N)/O

InChI

InChI=1S/C8H14N4O2S/c1-10-4-8(14)12-6(5-15-2)7(13)3-11-9/h3,6,10H,4-5H2,1-2H3,(H-,12,13,14)/p+1/b7-3+