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

Systemtic Name: N-(2-ethylsulfanylphenyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2-ethylsulfanylphenyl)-2-(4-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-[2-(ethylthio)phenyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2-ethylsulfanylphenyl)-2-(4-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(ethylthio)phenyl]-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1SCC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1SCC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S2/c1-5-18(20(23)21-17-9-7-8-10-19(17)26-6-2)22(27(4,24)25)16-13-11-15(3)12-14-16/h7-14,18H,5-6H2,1-4H3,(H,21,23)