(2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H27N3O3S2/c1-18-10-11-19(2)22(16-18)27-25(29)24(20-8-4-3-5-9-20)32-23-13-12-21(17-26-23)33(30,31)28-14-6-7-15-28/h3-5,8-13,16-17,24H,6-7,14-15H2,1-2H3,(H,27,29)/t24-/m0/s1