N-tert-butyl-3-nitro-4-phenylsulfanyl-benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-phenylsulfanyl-benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-phenylsulfanyl-benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-(phenylthio)benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-phenylsulfanylbenzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(phenylthio)benzenesulfonamide Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S2/c1-16(2,3)17-24(21,22)13-9-10-15(14(11-13)18(19)20)23-12-7-5-4-6-8-12/h4-11,17H,1-3H3