N-(2-methyl-1-methylsulfanyl-propan-2-yl)-2-nitro-benzamide

Systemtic Name: N-(2-methyl-1-methylsulfanyl-propan-2-yl)-2-nitro-benzamide Openeye Name: N-(1,1-dimethyl-2-methylsulfanyl-ethyl)-2-nitro-benzamide CAS Name: N-[2-methyl-1-(methylthio)propan-2-yl]-2-nitrobenzamide IUPAC Name: N-(2-methyl-1-methylsulfanylpropan-2-yl)-2-nitrobenzamide Traditional Name: N-[1,1-dimethyl-2-(methylthio)ethyl]-2-nitro-benzamide Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3S/c1-12(2,8-18-3)13-11(15)9-6-4-5-7-10(9)14(16)17/h4-7H,8H2,1-3H3,(H,13,15)