N-(2-cyclohexylsulfanylethyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-2-(4-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-[2-(cyclohexylthio)ethyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-2-(4-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C20H32N2O3S2 MolecularWeight: 412.60968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCSC1CCCCC1)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCSC1CCCCC1)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

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