N-[(4-methylsulfanylphenyl)methyl]-3-(4-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-3-(4-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-3-[4-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: N-[[4-(methylthio)phenyl]methyl]-3-[4-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-3-(4-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: N-[4-(methylthio)benzyl]-3-(4-piperidinosulfonylphenyl)benzamide Formula: C26H28N2O3S2 MolecularWeight: 480.64212

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H28N2O3S2/c1-32-24-12-8-20(9-13-24)19-27-26(29)23-7-5-6-22(18-23)21-10-14-25(15-11-21)33(30,31)28-16-3-2-4-17-28/h5-15,18H,2-4,16-17,19H2,1H3,(H,27,29)