N-(4-ethylsulfonylphenyl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(4-ethylsulfonylphenyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(4-ethylsulfonylphenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(4-ethylsulfonylphenyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(4-ethylsulfonylphenyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(4-esylphenyl)-4-(methylthio)-3-nitro-benzamide Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S2/c1-3-25(22,23)13-7-5-12(6-8-13)17-16(19)11-4-9-15(24-2)14(10-11)18(20)21/h4-10H,3H2,1-2H3,(H,17,19)