2-[(E)-2-(4-tert-butylphenyl)-1-(phenylsulfonyl)ethenyl]-1H-benzimidazole

Systemtic Name: 2-[(E)-2-(4-tert-butylphenyl)-1-(phenylsulfonyl)ethenyl]-1H-benzimidazole Openeye Name: 2-[(E)-1-(benzenesulfonyl)-2-(4-tert-butylphenyl)vinyl]-1H-benzimidazole CAS Name: 2-[(E)-1-(benzenesulfonyl)-2-(4-tert-butylphenyl)ethenyl]-1H-benzimidazole IUPAC Name: 2-[(E)-1-(benzenesulfonyl)-2-(4-tert-butylphenyl)ethenyl]-1H-benzimidazole Traditional Name: 2-[(E)-1-besyl-2-(4-tert-butylphenyl)vinyl]-1H-benzimidazole Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C(\C2=NC3=CC=CC=C3N2)/S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O2S/c1-25(2,3)19-15-13-18(14-16-19)17-23(30(28,29)20-9-5-4-6-10-20)24-26-21-11-7-8-12-22(21)27-24/h4-17H,1-3H3,(H,26,27)/b23-17+