N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-acetamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(phenylthio)acetamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-phenylsulfanylacetamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-(phenylthio)acetamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H24N2O4S2/c1-2-26-18-11-10-16(14-19(18)28(24,25)22-12-6-7-13-22)21-20(23)15-27-17-8-4-3-5-9-17/h3-5,8-11,14H,2,6-7,12-13,15H2,1H3,(H,21,23)