6-[[3-(4-methylphenyl)-2-sulfanylidene-1H-benzimidazol-5-yl]oxy]hexanoic acid

Systemtic Name: 6-[[3-(4-methylphenyl)-2-sulfanylidene-1H-benzimidazol-5-yl]oxy]hexanoic acid Openeye Name: 6-[[3-(p-tolyl)-2-thioxo-1H-benzimidazol-5-yl]oxy]hexanoic acid CAS Name: 6-[[3-(4-methylphenyl)-2-sulfanylidene-1H-benzimidazol-5-yl]oxy]hexanoic acid IUPAC Name: 6-[[3-(4-methylphenyl)-2-sulfanylidene-1H-benzimidazol-5-yl]oxy]hexanoic acid Traditional Name: 6-[[3-(p-tolyl)-2-thioxo-1H-benzimidazol-5-yl]oxy]hexanoic acid Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)O)NC2=S

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)O)NC2=S

InChI

InChI=1S/C20H22N2O3S/c1-14-6-8-15(9-7-14)22-18-13-16(10-11-17(18)21-20(22)26)25-12-4-2-3-5-19(23)24/h6-11,13H,2-5,12H2,1H3,(H,21,26)(H,23,24)