N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(2-phenoxyethylsulfanyl)ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(2-phenoxyethylsulfanyl)ethanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-(2-phenoxyethylsulfanyl)acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-(2-phenoxyethylthio)acetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-(2-phenoxyethylsulfanyl)acetamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-2-(2-phenoxyethylthio)acetamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSCCOC2=CC=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSCCOC2=CC=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28N2O4S2/c1-18-10-11-19(16-21(18)30(26,27)24-12-6-3-7-13-24)23-22(25)17-29-15-14-28-20-8-4-2-5-9-20/h2,4-5,8-11,16H,3,6-7,12-15,17H2,1H3,(H,23,25)