N-(2-phenylsulfanylphenyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-phenylsulfanylphenyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-phenylsulfanylphenyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-[2-(phenylthio)phenyl]-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-phenylsulfanylphenyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[2-(phenylthio)phenyl]-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C23H23N3O3S3 MolecularWeight: 485.64202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3S3/c27-22(25-20-10-4-5-11-21(20)31-18-8-2-1-3-9-18)17-30-23-13-12-19(16-24-23)32(28,29)26-14-6-7-15-26/h1-5,8-13,16H,6-7,14-15,17H2,(H,25,27)