(E)-2-(5-chloranylthiophen-2-yl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]ethenesulfonamide

Systemtic Name: (E)-2-(5-chloranylthiophen-2-yl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]ethenesulfonamide Openeye Name: (E)-2-(5-chloro-2-thienyl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]ethenesulfonamide CAS Name: (E)-2-(5-chloro-2-thiophenyl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluorophenyl]-2-oxo-3-pyrrolidinyl]ethenesulfonamide IUPAC Name: (E)-2-(5-chlorothiophen-2-yl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluorophenyl]-2-oxopyrrolidin-3-yl]ethenesulfonamide Traditional Name: (E)-2-(5-chloro-2-thienyl)-N-[1-[4-[1-(dimethylamino)propyl]-2-fluoro-phenyl]-2-keto-pyrrolidin-3-yl]ethenesulfonamide Formula: C21H25ClFN3O3S2 MolecularWeight: 486.022903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)N2CCC(C2=O)NS(=O)(=O)C=CC3=CC=C(S3)Cl)F)N(C)C

Isomeric SMILES

CCC(C1=CC(=C(C=C1)N2CCC(C2=O)NS(=O)(=O)/C=C/C3=CC=C(S3)Cl)F)N(C)C

InChI

InChI=1S/C21H25ClFN3O3S2/c1-4-18(25(2)3)14-5-7-19(16(23)13-14)26-11-9-17(21(26)27)24-31(28,29)12-10-15-6-8-20(22)30-15/h5-8,10,12-13,17-18,24H,4,9,11H2,1-3H3/b12-10+