N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]thio]acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanylacetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-[(4-pyrrolidinosulfonylphenyl)thio]acetamide Formula: C25H23ClN2O4S2 MolecularWeight: 515.04412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H23ClN2O4S2/c26-19-8-13-23(22(16-19)25(30)18-6-2-1-3-7-18)27-24(29)17-33-20-9-11-21(12-10-20)34(31,32)28-14-4-5-15-28/h1-3,6-13,16H,4-5,14-15,17H2,(H,27,29)