methyl 5-chloranyl-3-(4-fluorophenyl)sulfanyl-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-(4-fluorophenyl)sulfanyl-1H-indole-2-carboxylate Openeye Name: methyl 5-chloro-3-(4-fluorophenyl)sulfanyl-1H-indole-2-carboxylate CAS Name: 5-chloro-3-[(4-fluorophenyl)thio]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-(4-fluorophenyl)sulfanyl-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-[(4-fluorophenyl)thio]-1H-indole-2-carboxylic acid methyl ester Formula: C16H11ClFNO2S MolecularWeight: 335.780443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SC3=CC=C(C=C3)F

InChI

InChI=1S/C16H11ClFNO2S/c1-21-16(20)14-15(22-11-5-3-10(18)4-6-11)12-8-9(17)2-7-13(12)19-14/h2-8,19H,1H3