2-methyl-N-[4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoyl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoyl]phenyl]propanamide Openeye Name: 2-methyl-N-[4-[2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]propanoyl]phenyl]propanamide CAS Name: 2-methyl-N-[4-[1-oxo-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]propyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoyl]phenyl]propanamide Traditional Name: 2-methyl-N-[4-[2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propanoyl]phenyl]propionamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27N3O4S2/c1-15(2)22(27)24-18-8-6-17(7-9-18)21(26)16(3)30-20-11-10-19(14-23-20)31(28,29)25-12-4-5-13-25/h6-11,14-16H,4-5,12-13H2,1-3H3,(H,24,27)