N-methyl-1-[4-[[(2R)-1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl]carbamoyl]phenyl]methanimine oxide

Systemtic Name: N-methyl-1-[4-[[(2R)-1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl]carbamoyl]phenyl]methanimine oxide Openeye Name: 1-[4-[[(1R)-2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]phenyl]-N-methyl-methanimine oxide CAS Name: 1-[4-[[[(2R)-1-hydroxy-3-mercapto-1-oxopropan-2-yl]amino]-oxomethyl]phenyl]-N-methylmethanimine oxide IUPAC Name: 1-[4-[[(2R)-1-hydroxy-1-oxo-3-sulfanylpropan-2-yl]carbamoyl]phenyl]-N-methylmethanimine oxide Traditional Name: 1-[4-[[(1R)-2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]phenyl]-N-methyl-methanimine oxide Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CC1=CC=C(C=C1)C(=O)NC(CS)C(=O)O)[O-]

Isomeric SMILES

C/[N+](=C/C1=CC=C(C=C1)C(=O)N[C@@H](CS)C(=O)O)/[O-]

InChI

InChI=1S/C12H14N2O4S/c1-14(18)6-8-2-4-9(5-3-8)11(15)13-10(7-19)12(16)17/h2-6,10,19H,7H2,1H3,(H,13,15)(H,16,17)/b14-6-/t10-/m0/s1