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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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