6-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]hexanoic acid

Systemtic Name: 6-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]hexanoic acid Openeye Name: 6-[4,5-bis(4-chlorophenyl)oxazol-2-yl]sulfanylhexanoic acid CAS Name: 6-[[4,5-bis(4-chlorophenyl)-2-oxazolyl]thio]hexanoic acid IUPAC Name: 6-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]hexanoic acid Traditional Name: 6-[[4,5-bis(4-chlorophenyl)oxazol-2-yl]thio]hexanoic acid Formula: C21H19Cl2NO3S MolecularWeight: 436.35146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(OC(=N2)SCCCCCC(=O)O)C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(OC(=N2)SCCCCCC(=O)O)C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2NO3S/c22-16-9-5-14(6-10-16)19-20(15-7-11-17(23)12-8-15)27-21(24-19)28-13-3-1-2-4-18(25)26/h5-12H,1-4,13H2,(H,25,26)