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

Systemtic Name: 5-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]pentanoic acid Openeye Name: 5-[4,5-bis(4-chlorophenyl)oxazol-2-yl]sulfanylpentanoic acid CAS Name: 5-[[4,5-bis(4-chlorophenyl)-2-oxazolyl]thio]pentanoic acid IUPAC Name: 5-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]pentanoic acid Traditional Name: 5-[[4,5-bis(4-chlorophenyl)oxazol-2-yl]thio]valeric acid Formula: C20H17Cl2NO3S MolecularWeight: 422.32488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17Cl2NO3S/c21-15-8-4-13(5-9-15)18-19(14-6-10-16(22)11-7-14)26-20(23-18)27-12-2-1-3-17(24)25/h4-11H,1-3,12H2,(H,24,25)