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

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(4-fluorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetamide Formula: C24H31FN2O4S2 MolecularWeight: 494.642343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H31FN2O4S2/c1-31-21-12-14-23(15-13-21)33(29,30)27(20-10-8-19(25)9-11-20)18-24(28)26-16-5-17-32-22-6-3-2-4-7-22/h8-15,22H,2-7,16-18H2,1H3,(H,26,28)