2-(4-methylphenyl)sulfanyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide Openeye Name: N-[[2-(1-piperidylsulfonyl)phenyl]methyl]-2-(p-tolylsulfanyl)propanamide CAS Name: 2-[(4-methylphenyl)thio]-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide Traditional Name: N-(2-piperidinosulfonylbenzyl)-2-(p-tolylthio)propionamide Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28N2O3S2/c1-17-10-12-20(13-11-17)28-18(2)22(25)23-16-19-8-4-5-9-21(19)29(26,27)24-14-6-3-7-15-24/h4-5,8-13,18H,3,6-7,14-16H2,1-2H3,(H,23,25)