N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-[(2,4-dichlorophenyl)methylthio]ethyl]-2-methoxy-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[(2,4-dichlorobenzyl)thio]ethyl]-2-methoxy-5-piperidinosulfonyl-benzamide Formula: C22H26Cl2N2O4S2 MolecularWeight: 517.48884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H26Cl2N2O4S2/c1-30-21-8-7-18(32(28,29)26-10-3-2-4-11-26)14-19(21)22(27)25-9-12-31-15-16-5-6-17(23)13-20(16)24/h5-8,13-14H,2-4,9-12,15H2,1H3,(H,25,27)