3-nitro-4-phenylsulfanyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-nitro-4-phenylsulfanyl-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-phenylsulfanyl-benzenesulfonamide CAS Name: 3-nitro-4-(phenylthio)-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-nitro-4-phenylsulfanyl-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-3-nitro-4-(phenylthio)benzenesulfonamide Formula: C15H16N2O4S2 MolecularWeight: 352.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4S2/c1-11(2)16-23(20,21)13-8-9-15(14(10-13)17(18)19)22-12-6-4-3-5-7-12/h3-11,16H,1-2H3