N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(4-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(p-tolylmethylsulfanyl)acetamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-[(4-methylphenyl)methylthio]acetamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-[(4-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-[(4-methylbenzyl)thio]acetamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H28N2O4S2/c1-3-28-20-11-10-19(14-21(20)30(26,27)24-12-4-5-13-24)23-22(25)16-29-15-18-8-6-17(2)7-9-18/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,23,25)