3-[1-[(4-chlorophenyl)methyl]-5-fluoranyl-3-methylsulfanyl-indol-2-yl]propanoic acid

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]-5-fluoranyl-3-methylsulfanyl-indol-2-yl]propanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-5-fluoro-3-methylsulfanyl-indol-2-yl]propanoic acid CAS Name: 3-[1-[(4-chlorophenyl)methyl]-5-fluoro-3-(methylthio)-2-indolyl]propanoic acid IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-5-fluoro-3-methylsulfanylindol-2-yl]propanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-5-fluoro-3-(methylthio)indol-2-yl]propionic acid Formula: C19H17ClFNO2S MolecularWeight: 377.860183

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=C(C=C3)Cl)CCC(=O)O

Isomeric SMILES

CSC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=C(C=C3)Cl)CCC(=O)O

InChI

InChI=1S/C19H17ClFNO2S/c1-25-19-15-10-14(21)6-7-16(15)22(17(19)8-9-18(23)24)11-12-2-4-13(20)5-3-12/h2-7,10H,8-9,11H2,1H3,(H,23,24)