N-(3-cyclohexylsulfanylpropyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C24H31FN2O3S3 MolecularWeight: 510.707943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC(=CC=C3)F

InChI

InChI=1S/C24H31FN2O3S3/c1-31-21-11-13-23(14-12-21)33(29,30)27(20-8-5-7-19(25)17-20)18-24(28)26-15-6-16-32-22-9-3-2-4-10-22/h5,7-8,11-14,17,22H,2-4,6,9-10,15-16,18H2,1H3,(H,26,28)