2-(2,4-dimethylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(2,4-dimethylphenyl)sulfanyl-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(2,4-dimethylphenyl)thio]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2,4-dimethylphenyl)thio]-N-(3-piperidinosulfonylphenyl)acetamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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