2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]acetamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC(=C(C=C2)N3CCCC3=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC(=C(C=C2)N3CCCC3=O)OC

InChI

InChI=1S/C20H21BrN2O3S/c1-13-10-14(21)5-8-18(13)27-12-19(24)22-15-6-7-16(17(11-15)26-2)23-9-3-4-20(23)25/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,22,24)