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

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(2-ethylsulfanylphenyl)butanamide Openeye Name: 4-(2,5-dichloro-N-methylsulfonyl-anilino)-N-(2-ethylsulfanylphenyl)butanamide CAS Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-[2-(ethylthio)phenyl]butanamide IUPAC Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-ethylsulfanylphenyl)butanamide Traditional Name: 4-(2,5-dichloro-N-mesyl-anilino)-N-[2-(ethylthio)phenyl]butyramide Formula: C19H22Cl2N2O3S2 MolecularWeight: 461.42558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H22Cl2N2O3S2/c1-3-27-18-8-5-4-7-16(18)22-19(24)9-6-12-23(28(2,25)26)17-13-14(20)10-11-15(17)21/h4-5,7-8,10-11,13H,3,6,9,12H2,1-2H3,(H,22,24)