5-methyl-N'-(3-nitro-4-oxidanyl-phenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: 5-methyl-N'-(3-nitro-4-oxidanyl-phenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-(4-hydroxy-3-nitro-phenyl)sulfonyl-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: N'-(4-hydroxy-3-nitrophenyl)sulfonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-(4-hydroxy-3-nitrophenyl)sulfonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-(4-hydroxy-3-nitro-phenyl)sulfonyl-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6S2/c1-9-2-5-14-10(6-9)7-15(26-14)16(21)17-18-27(24,25)11-3-4-13(20)12(8-11)19(22)23/h3-4,7-9,18,20H,2,5-6H2,1H3,(H,17,21)