2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanyl-4-chloranyl-butanoic acid

Systemtic Name: 2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanyl-4-chloranyl-butanoic acid Openeye Name: 2-(5-amino-2-chloro-4-fluoro-phenyl)sulfanyl-4-chloro-butanoic acid CAS Name: 2-[(5-amino-2-chloro-4-fluorophenyl)thio]-4-chlorobutanoic acid IUPAC Name: 2-(5-amino-2-chloro-4-fluorophenyl)sulfanyl-4-chlorobutanoic acid Traditional Name: 2-[(5-amino-2-chloro-4-fluoro-phenyl)thio]-4-chloro-butyric acid Formula: C10H10Cl2FNO2S MolecularWeight: 298.161303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1SC(CCCl)C(=O)O)Cl)F)N

Isomeric SMILES

C1=C(C(=CC(=C1SC(CCCl)C(=O)O)Cl)F)N

InChI

InChI=1S/C10H10Cl2FNO2S/c11-2-1-8(10(15)16)17-9-4-7(14)6(13)3-5(9)12/h3-4,8H,1-2,14H2,(H,15,16)