4-methyl-3-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[2-(2-pyridylsulfanyl)ethyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[2-(2-pyridinylthio)ethyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[2-(2-pyridylthio)ethyl]benzenesulfonamide Formula: C14H15N3O4S2 MolecularWeight: 353.4166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O4S2/c1-11-5-6-12(10-13(11)17(18)19)23(20,21)16-8-9-22-14-4-2-3-7-15-14/h2-7,10,16H,8-9H2,1H3