4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(2-methylsulfanylphenyl)butanamide

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(2-methylsulfanylphenyl)butanamide Openeye Name: 4-(2,5-dichloro-N-methylsulfonyl-anilino)-N-(2-methylsulfanylphenyl)butanamide CAS Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-[2-(methylthio)phenyl]butanamide IUPAC Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylsulfanylphenyl)butanamide Traditional Name: 4-(2,5-dichloro-N-mesyl-anilino)-N-[2-(methylthio)phenyl]butyramide Formula: C18H20Cl2N2O3S2 MolecularWeight: 447.399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H20Cl2N2O3S2/c1-26-17-7-4-3-6-15(17)21-18(23)8-5-11-22(27(2,24)25)16-12-13(19)9-10-14(16)20/h3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,21,23)