3-methylsulfanyl-N-[4-(4-nitrophenyl)sulfonylphenyl]propanamide

Systemtic Name: 3-methylsulfanyl-N-[4-(4-nitrophenyl)sulfonylphenyl]propanamide Openeye Name: 3-methylsulfanyl-N-[4-(4-nitrophenyl)sulfonylphenyl]propanamide CAS Name: 3-(methylthio)-N-[4-(4-nitrophenyl)sulfonylphenyl]propanamide IUPAC Name: 3-methylsulfanyl-N-[4-(4-nitrophenyl)sulfonylphenyl]propanamide Traditional Name: 3-(methylthio)-N-(4-nosylphenyl)propionamide Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S2/c1-24-11-10-16(19)17-12-2-6-14(7-3-12)25(22,23)15-8-4-13(5-9-15)18(20)21/h2-9H,10-11H2,1H3,(H,17,19)