methyl 3-(5-fluoranyl-2,3-dimethyl-4-methylsulfanyl-phenyl)-4-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-(5-fluoranyl-2,3-dimethyl-4-methylsulfanyl-phenyl)-4-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-(5-fluoro-2,3-dimethyl-4-methylsulfanyl-phenyl)-4-phenyl-thiophene-2-carboxylate CAS Name: 3-[5-fluoro-2,3-dimethyl-4-(methylthio)phenyl]-4-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(5-fluoro-2,3-dimethyl-4-methylsulfanylphenyl)-4-phenylthiophene-2-carboxylate Traditional Name: 3-[5-fluoro-2,3-dimethyl-4-(methylthio)phenyl]-4-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C21H19FO2S2 MolecularWeight: 386.502763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C2=C(SC=C2C3=CC=CC=C3)C(=O)OC)F)SC)C

Isomeric SMILES

CC1=C(C(=C(C=C1C2=C(SC=C2C3=CC=CC=C3)C(=O)OC)F)SC)C

InChI

InChI=1S/C21H19FO2S2/c1-12-13(2)19(25-4)17(22)10-15(12)18-16(14-8-6-5-7-9-14)11-26-20(18)21(23)24-3/h5-11H,1-4H3