N-tert-butyl-1-[7-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]naphthalen-2-yl]methanimine oxide

Systemtic Name: N-tert-butyl-1-[7-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]naphthalen-2-yl]methanimine oxide Openeye Name: N-tert-butyl-1-[7-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-2-naphthyl]methanimine oxide CAS Name: N-tert-butyl-1-[7-[[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-oxomethyl]-2-naphthalenyl]methanimine oxide IUPAC Name: N-tert-butyl-1-[7-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)carbamoyl]naphthalen-2-yl]methanimine oxide Traditional Name: N-tert-butyl-1-[7-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]-2-naphthyl]methanimine oxide Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](=CC1=CC2=C(C=C1)C=CC(=C2)C(=O)NC(CS)C(=O)O)[O-]

Isomeric SMILES

CC(C)(C)/[N+](=C/C1=CC2=C(C=C1)C=CC(=C2)C(=O)NC(CS)C(=O)O)/[O-]

InChI

InChI=1S/C19H22N2O4S/c1-19(2,3)21(25)10-12-4-5-13-6-7-14(9-15(13)8-12)17(22)20-16(11-26)18(23)24/h4-10,16,26H,11H2,1-3H3,(H,20,22)(H,23,24)/b21-10-