4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-(5-tert-butyl-2-methyl-phenyl)sulfonyl-benzohydrazide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-(5-tert-butyl-2-methyl-phenyl)sulfonyl-benzohydrazide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-(5-tert-butyl-2-methyl-phenyl)sulfonyl-benzohydrazide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N'-(5-tert-butyl-2-methylphenyl)sulfonylbenzohydrazide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-(5-tert-butyl-2-methylphenyl)sulfonylbenzohydrazide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N'-(5-tert-butyl-2-methyl-phenyl)sulfonyl-benzohydrazide Formula: C26H28N4O3S2 MolecularWeight: 508.65552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H28N4O3S2/c1-17-9-14-20(26(2,3)4)15-23(17)35(32,33)30-29-24(31)19-12-10-18(11-13-19)16-34-25-27-21-7-5-6-8-22(21)28-25/h5-15,30H,16H2,1-4H3,(H,27,28)(H,29,31)