3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]propanamide

Systemtic Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-(p-tolylmethylsulfanyl)ethyl]propanamide CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-[(4-methylphenyl)methylthio]ethyl]propanamide IUPAC Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]propanamide Traditional Name: N-[2-[(4-methylbenzyl)thio]ethyl]-3-(p-phenetylsulfonylamino)propionamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCSCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCSCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H28N2O4S2/c1-3-27-19-8-10-20(11-9-19)29(25,26)23-13-12-21(24)22-14-15-28-16-18-6-4-17(2)5-7-18/h4-11,23H,3,12-16H2,1-2H3,(H,22,24)