N-(2-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-methylsulfanylphenyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-[2-(methylthio)phenyl]-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-methylsulfanylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[2-(methylthio)phenyl]-3-(4-piperidinosulfonylphenyl)propionamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O3S2/c1-27-20-8-4-3-7-19(20)22-21(24)14-11-17-9-12-18(13-10-17)28(25,26)23-15-5-2-6-16-23/h3-4,7-10,12-13H,2,5-6,11,14-16H2,1H3,(H,22,24)