N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(3-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(3-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(m-tolylmethylsulfanyl)acetamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(3-methylphenyl)methylthio]acetamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-[(3-methylphenyl)methylsulfanyl]acetamide Traditional Name: 2-[(3-methylbenzyl)thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H26N2O4S2/c1-16-4-3-5-18(12-16)14-28-15-21(24)22-19-7-6-17(2)20(13-19)29(25,26)23-8-10-27-11-9-23/h3-7,12-13H,8-11,14-15H2,1-2H3,(H,22,24)