5-tert-butyl-N'-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: 5-tert-butyl-N'-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: 5-tert-butyl-N'-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: 5-tert-butyl-N'-[oxo-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: 5-tert-butyl-N'-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: 5-tert-butyl-N'-[2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C26H33N3O3S2 MolecularWeight: 499.68852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=CC=C3SCC(=O)N4CCCC4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=CC=C3SCC(=O)N4CCCC4

InChI

InChI=1S/C26H33N3O3S2/c1-26(2,3)18-10-11-20-17(14-18)15-22(34-20)25(32)28-27-24(31)19-8-4-5-9-21(19)33-16-23(30)29-12-6-7-13-29/h4-5,8-9,15,18H,6-7,10-14,16H2,1-3H3,(H,27,31)(H,28,32)