2-[(3-chlorophenyl)methylsulfanyl]-N-(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(4-ethoxy-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[4-ethoxy-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-(4-ethoxy-3-morpholinosulfonyl-phenyl)acetamide Formula: C21H25ClN2O5S2 MolecularWeight: 485.0166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=CC(=CC=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=CC(=CC=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25ClN2O5S2/c1-2-29-19-7-6-18(13-20(19)31(26,27)24-8-10-28-11-9-24)23-21(25)15-30-14-16-4-3-5-17(22)12-16/h3-7,12-13H,2,8-11,14-15H2,1H3,(H,23,25)