N-[3-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[3-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[3-[[3-(4-methylsulfanylbenzoyl)-1-piperidyl]sulfonyl]phenyl]acetamide CAS Name: N-[3-[[3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[3-[3-(4-methylsulfanylbenzoyl)piperidin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[3-[3-[4-(methylthio)benzoyl]piperidino]sulfonylphenyl]acetamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H24N2O4S2/c1-15(24)22-18-6-3-7-20(13-18)29(26,27)23-12-4-5-17(14-23)21(25)16-8-10-19(28-2)11-9-16/h3,6-11,13,17H,4-5,12,14H2,1-2H3,(H,22,24)