5-tert-butyl-N'-(4-nitrophenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: 5-tert-butyl-N'-(4-nitrophenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: 5-tert-butyl-N'-(4-nitrophenyl)sulfonyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: 5-tert-butyl-N'-(4-nitrophenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: 5-tert-butyl-N'-(4-nitrophenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: 5-tert-butyl-N'-nosyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O5S2/c1-19(2,3)13-4-9-16-12(10-13)11-17(28-16)18(23)20-21-29(26,27)15-7-5-14(6-8-15)22(24)25/h5-8,11,13,21H,4,9-10H2,1-3H3,(H,20,23)