5-tert-butyl-N'-[2-(1-phenylpyrazol-4-yl)ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: 5-tert-butyl-N'-[2-(1-phenylpyrazol-4-yl)ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: 5-tert-butyl-N'-[2-(1-phenylpyrazol-4-yl)acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: 5-tert-butyl-N'-[1-oxo-2-(1-phenyl-4-pyrazolyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: 5-tert-butyl-N'-[2-(1-phenylpyrazol-4-yl)acetyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: 5-tert-butyl-N'-[2-(1-phenylpyrazol-4-yl)acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2S/c1-24(2,3)18-9-10-20-17(12-18)13-21(31-20)23(30)27-26-22(29)11-16-14-25-28(15-16)19-7-5-4-6-8-19/h4-8,13-15,18H,9-12H2,1-3H3,(H,26,29)(H,27,30)