2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-[3-(2-ketopyrrolidino)propyl]acetamide Formula: C17H23BrN2O2S MolecularWeight: 399.34572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NCCCN2CCCC2=O

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NCCCN2CCCC2=O

InChI

InChI=1S/C17H23BrN2O2S/c1-12-10-15(13(2)9-14(12)18)23-11-16(21)19-6-4-8-20-7-3-5-17(20)22/h9-10H,3-8,11H2,1-2H3,(H,19,21)