2-(4-methylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-(p-tolylsulfanyl)propanamide CAS Name: 2-[(4-methylphenyl)thio]-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-(p-tolylthio)propionamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O3S2/c1-16-9-11-19(12-10-16)27-17(2)21(24)22-18-7-6-8-20(15-18)28(25,26)23-13-4-3-5-14-23/h6-12,15,17H,3-5,13-14H2,1-2H3,(H,22,24)