N-tert-butyl-1-[5-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]thiophen-2-yl]methanimine oxide

Systemtic Name: N-tert-butyl-1-[5-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]thiophen-2-yl]methanimine oxide Openeye Name: N-tert-butyl-1-[5-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-2-thienyl]methanimine oxide CAS Name: N-tert-butyl-1-[5-[[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-oxomethyl]-2-thiophenyl]methanimine oxide IUPAC Name: N-tert-butyl-1-[5-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)carbamoyl]thiophen-2-yl]methanimine oxide Traditional Name: N-tert-butyl-1-[5-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]-2-thienyl]methanimine oxide Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](=CC1=CC=C(S1)C(=O)NC(CS)C(=O)O)[O-]

Isomeric SMILES

CC(C)(C)/[N+](=C\C1=CC=C(S1)C(=O)NC(CS)C(=O)O)/[O-]

InChI

InChI=1S/C13H18N2O4S2/c1-13(2,3)15(19)6-8-4-5-10(21-8)11(16)14-9(7-20)12(17)18/h4-6,9,20H,7H2,1-3H3,(H,14,16)(H,17,18)/b15-6+