2-(4-methylphenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]ethanamide Openeye Name: N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-2-(p-tolylsulfanyl)acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]acetamide Traditional Name: N-[4-(3-methylpiperidino)sulfonylphenyl]-2-(p-tolylthio)acetamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)C

InChI

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