N-(3-cyclohexylsulfanylpropyl)-2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-(2,5-dimethyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(2,5-dimethyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(2,5-dimethyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(N-mesyl-2,5-dimethyl-anilino)acetamide Formula: C20H32N2O3S2 MolecularWeight: 412.60968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)NCCCSC2CCCCC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)NCCCSC2CCCCC2)S(=O)(=O)C

InChI

InChI=1S/C20H32N2O3S2/c1-16-10-11-17(2)19(14-16)22(27(3,24)25)15-20(23)21-12-7-13-26-18-8-5-4-6-9-18/h10-11,14,18H,4-9,12-13,15H2,1-3H3,(H,21,23)