2-chloranyl-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(4-methylsulfanylphenyl)methyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[[4-(methylthio)phenyl]methyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(methylthio)benzyl]-5-piperidinosulfonyl-benzamide Formula: C20H23ClN2O3S2 MolecularWeight: 438.99122

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C20H23ClN2O3S2/c1-27-16-7-5-15(6-8-16)14-22-20(24)18-13-17(9-10-19(18)21)28(25,26)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,24)