2-[1-(3,5-dimethylphenyl)-4,5-diphenyl-imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(3,5-dimethylphenyl)-4,5-diphenyl-imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-(3,5-dimethylphenyl)-4,5-diphenyl-imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-(3,5-dimethylphenyl)-4,5-diphenyl-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[1-(3,5-dimethylphenyl)-4,5-diphenylimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-(3,5-dimethylphenyl)-4,5-diphenyl-imidazol-2-yl]thio]acetic acid Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(N=C2SCC(=O)O)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C(N=C2SCC(=O)O)C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H22N2O2S/c1-17-13-18(2)15-21(14-17)27-24(20-11-7-4-8-12-20)23(19-9-5-3-6-10-19)26-25(27)30-16-22(28)29/h3-15H,16H2,1-2H3,(H,28,29)