2-[5-(5-chloranylthiophen-2-yl)-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-(5-chloranylthiophen-2-yl)-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]ethanoic acid Openeye Name: 2-[5-(5-chloro-2-thienyl)-2-(4-methylsulfanylphenyl)oxazol-4-yl]acetic acid CAS Name: 2-[5-(5-chloro-2-thiophenyl)-2-[4-(methylthio)phenyl]-4-oxazolyl]acetic acid IUPAC Name: 2-[5-(5-chlorothiophen-2-yl)-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]acetic acid Traditional Name: 2-[5-(5-chloro-2-thienyl)-2-[4-(methylthio)phenyl]oxazol-4-yl]acetic acid Formula: C16H12ClNO3S2 MolecularWeight: 365.85438

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=C(S3)Cl)CC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=C(S3)Cl)CC(=O)O

InChI

InChI=1S/C16H12ClNO3S2/c1-22-10-4-2-9(3-5-10)16-18-11(8-14(19)20)15(21-16)12-6-7-13(17)23-12/h2-7H,8H2,1H3,(H,19,20)