N-tert-butyl-4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[(1-methyl-2-imidazolyl)thio]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(1-methylimidazol-2-yl)sulfanyl-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(1-methylimidazol-2-yl)thio]-3-nitro-benzenesulfonamide Formula: C14H18N4O4S2 MolecularWeight: 370.44712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)SC2=NC=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)SC2=NC=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4S2/c1-14(2,3)16-24(21,22)10-5-6-12(11(9-10)18(19)20)23-13-15-7-8-17(13)4/h5-9,16H,1-4H3