2-butyl-1-methyl-3-[4-[2-(5-sulfanylidene-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-butyl-1-methyl-3-[4-[2-(5-sulfanylidene-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid Openeye Name: 2-butyl-1-methyl-3-[4-[2-(5-thioxo-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid CAS Name: 2-butyl-1-methyl-3-[4-[2-(5-sulfanylidene-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid IUPAC Name: 2-butyl-1-methyl-3-[4-[2-(5-sulfanylidene-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid Traditional Name: 2-butyl-1-methyl-3-[4-[2-(5-thioxo-2H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-2H-benzimidazole-4-carboxylic acid Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C2=CC=CC(=C2N1C3=CC=C(C=C3)C4=CC=CC=C4C5=NC(=S)ON5)C(=O)O)C

Isomeric SMILES

CCCCC1N(C2=CC=CC(=C2N1C3=CC=C(C=C3)C4=CC=CC=C4C5=NC(=S)ON5)C(=O)O)C

InChI

InChI=1S/C27H26N4O3S/c1-3-4-12-23-30(2)22-11-7-10-21(26(32)33)24(22)31(23)18-15-13-17(14-16-18)19-8-5-6-9-20(19)25-28-27(35)34-29-25/h5-11,13-16,23H,3-4,12H2,1-2H3,(H,32,33)(H,28,29,35)