N-tert-butyl-1-[4-(2-sulfanylethylcarbamoyl)phenyl]methanimine oxide

Systemtic Name: N-tert-butyl-1-[4-(2-sulfanylethylcarbamoyl)phenyl]methanimine oxide Openeye Name: N-tert-butyl-1-[4-(2-sulfanylethylcarbamoyl)phenyl]methanimine oxide CAS Name: N-tert-butyl-1-[4-[(2-mercaptoethylamino)-oxomethyl]phenyl]methanimine oxide IUPAC Name: N-tert-butyl-1-[4-(2-sulfanylethylcarbamoyl)phenyl]methanimine oxide Traditional Name: N-tert-butyl-1-[4-(2-mercaptoethylcarbamoyl)phenyl]methanimine oxide Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)/[N+](=C/C1=CC=C(C=C1)C(=O)NCCS)/[O-]

InChI

InChI=1S/C14H20N2O2S/c1-14(2,3)16(18)10-11-4-6-12(7-5-11)13(17)15-8-9-19/h4-7,10,19H,8-9H2,1-3H3,(H,15,17)/b16-10-