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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCC3

Isomeric SMILES

CCSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O4S2/c1-3-28-20-10-6-5-9-18(20)22-29(25,26)16-11-12-19(27-2)17(15-16)21(24)23-13-7-4-8-14-23/h5-6,9-12,15,22H,3-4,7-8,13-14H2,1-2H3