N-(3-morpholin-4-ylsulfonylphenyl)-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(3-morpholin-4-ylsulfonylphenyl)-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(3-morpholinosulfonylphenyl)-2-(2,4,6-trimethylphenyl)sulfanyl-acetamide CAS Name: N-[3-(4-morpholinylsulfonyl)phenyl]-2-[(2,4,6-trimethylphenyl)thio]acetamide IUPAC Name: N-(3-morpholin-4-ylsulfonylphenyl)-2-(2,4,6-trimethylphenyl)sulfanylacetamide Traditional Name: 2-(mesitylthio)-N-(3-morpholinosulfonylphenyl)acetamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S2/c1-15-11-16(2)21(17(3)12-15)28-14-20(24)22-18-5-4-6-19(13-18)29(25,26)23-7-9-27-10-8-23/h4-6,11-13H,7-10,14H2,1-3H3,(H,22,24)