4-(methylsulfanylmethyl)-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-(methylsulfanylmethyl)-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-(methylsulfanylmethyl)-N-[3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-[(methylthio)methyl]-N-[3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(methylsulfanylmethyl)-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(methylthio)methyl]-N-(3-piperidinosulfonylphenyl)benzamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H24N2O3S2/c1-26-15-16-8-10-17(11-9-16)20(23)21-18-6-5-7-19(14-18)27(24,25)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13,15H2,1H3,(H,21,23)