N-[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]-2-methylsulfanyl-ethanamide

Systemtic Name: N-[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]-2-methylsulfanyl-ethanamide Openeye Name: N-[2-(3-methylphenoxy)-5-(1-piperidylsulfonyl)phenyl]-2-methylsulfanyl-acetamide CAS Name: N-[2-(3-methylphenoxy)-5-(1-piperidinylsulfonyl)phenyl]-2-(methylthio)acetamide IUPAC Name: N-[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonylphenyl]-2-methylsulfanylacetamide Traditional Name: N-[2-(3-methylphenoxy)-5-piperidinosulfonyl-phenyl]-2-(methylthio)acetamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CSC

Isomeric SMILES

CC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CSC

InChI

InChI=1S/C21H26N2O4S2/c1-16-7-6-8-17(13-16)27-20-10-9-18(14-19(20)22-21(24)15-28-2)29(25,26)23-11-4-3-5-12-23/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,22,24)