2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide

Systemtic Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]-N-(2,4,6-trimethylphenyl)propanamide CAS Name: 2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: N-mesityl-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propionamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C21H27N3O3S2/c1-14-11-15(2)20(16(3)12-14)23-21(25)17(4)28-19-8-7-18(13-22-19)29(26,27)24-9-5-6-10-24/h7-8,11-13,17H,5-6,9-10H2,1-4H3,(H,23,25)