N-tert-butyl-4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(4,5-dimethyloxazol-2-yl)sulfanyl-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[(4,5-dimethyl-2-oxazolyl)thio]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(4,5-dimethyloxazol-2-yl)thio]-3-nitro-benzenesulfonamide Formula: C15H19N3O5S2 MolecularWeight: 385.45846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=N1)SC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(OC(=N1)SC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H19N3O5S2/c1-9-10(2)23-14(16-9)24-13-7-6-11(8-12(13)18(19)20)25(21,22)17-15(3,4)5/h6-8,17H,1-5H3