N-(2-cyclohexylsulfanylethyl)-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-2-(3,4-dimethyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-(cyclohexylthio)ethyl]-2-(3,4-dimethyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-2-(3,4-dimethyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-2-(N-mesyl-3,4-dimethyl-anilino)acetamide Formula: C19H30N2O3S2 MolecularWeight: 398.5831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCCSC2CCCCC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCCSC2CCCCC2)S(=O)(=O)C)C

InChI

InChI=1S/C19H30N2O3S2/c1-15-9-10-17(13-16(15)2)21(26(3,23)24)14-19(22)20-11-12-25-18-7-5-4-6-8-18/h9-10,13,18H,4-8,11-12,14H2,1-3H3,(H,20,22)