2-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-N-[3-(4-oxidanyl-2-oxidanylidene-pyrrolidin-1-yl)propyl]prop-2-enamide

Systemtic Name: 2-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-N-[3-(4-oxidanyl-2-oxidanylidene-pyrrolidin-1-yl)propyl]prop-2-enamide Openeye Name: 2-[4-(2-bromophenyl)sulfanyl-3-chloro-phenyl]-N-[3-(4-hydroxy-2-oxo-pyrrolidin-1-yl)propyl]prop-2-enamide CAS Name: 2-[4-[(2-bromophenyl)thio]-3-chlorophenyl]-N-[3-(4-hydroxy-2-oxo-1-pyrrolidinyl)propyl]-2-propenamide IUPAC Name: 2-[4-(2-bromophenyl)sulfanyl-3-chlorophenyl]-N-[3-(4-hydroxy-2-oxopyrrolidin-1-yl)propyl]prop-2-enamide Traditional Name: 2-[4-[(2-bromophenyl)thio]-3-chloro-phenyl]-N-[3-(4-hydroxy-2-keto-pyrrolidino)propyl]acrylamide Formula: C22H22BrClN2O3S MolecularWeight: 509.84368

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=C(C=C1)SC2=CC=CC=C2Br)Cl)C(=O)NCCCN3CC(CC3=O)O

Isomeric SMILES

C=C(C1=CC(=C(C=C1)SC2=CC=CC=C2Br)Cl)C(=O)NCCCN3CC(CC3=O)O

InChI

InChI=1S/C22H22BrClN2O3S/c1-14(22(29)25-9-4-10-26-13-16(27)12-21(26)28)15-7-8-20(18(24)11-15)30-19-6-3-2-5-17(19)23/h2-3,5-8,11,16,27H,1,4,9-10,12-13H2,(H,25,29)