4-methoxy-N-(2-phenylsulfanylethyl)-3-piperidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: 4-methoxy-N-(2-phenylsulfanylethyl)-3-piperidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: 4-methoxy-N-(2-phenylsulfanylethyl)-3-(piperidine-1-carbonyl)benzenesulfonamide CAS Name: 4-methoxy-3-[oxo(1-piperidinyl)methyl]-N-[2-(phenylthio)ethyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-(2-phenylsulfanylethyl)-3-(piperidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-methoxy-N-[2-(phenylthio)ethyl]-3-(piperidine-1-carbonyl)benzenesulfonamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O4S2/c1-27-20-11-10-18(16-19(20)21(24)23-13-6-3-7-14-23)29(25,26)22-12-15-28-17-8-4-2-5-9-17/h2,4-5,8-11,16,22H,3,6-7,12-15H2,1H3