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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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