N-(4-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(4-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(4-methylsulfanylphenyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-[4-(methylthio)phenyl]-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(4-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[4-(methylthio)phenyl]-3-(4-piperidinosulfonylphenyl)propionamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O3S2/c1-27-19-10-8-18(9-11-19)22-21(24)14-7-17-5-12-20(13-6-17)28(25,26)23-15-3-2-4-16-23/h5-6,8-13H,2-4,7,14-16H2,1H3,(H,22,24)