N-(3-cyclohexylsulfanylpropyl)-2-[(2,3-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(2,3-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-[2,3-dimethyl-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(2,3-dimethyl-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(2,3-dimethyl-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(2,3-dimethyl-N-tosyl-anilino)acetamide Formula: C26H36N2O3S2 MolecularWeight: 488.70564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C26H36N2O3S2/c1-20-13-15-24(16-14-20)33(30,31)28(25-12-7-9-21(2)22(25)3)19-26(29)27-17-8-18-32-23-10-5-4-6-11-23/h7,9,12-16,23H,4-6,8,10-11,17-19H2,1-3H3,(H,27,29)