2-chloranyl-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-5-(methylthio)benzamide Formula: C21H25ClN2O4S2 MolecularWeight: 469.0172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)SC)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)SC)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25ClN2O4S2/c1-3-28-19-10-7-15(13-20(19)30(26,27)24-11-5-4-6-12-24)23-21(25)17-14-16(29-2)8-9-18(17)22/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,23,25)