N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(2-fluoro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H23FN2O2S2 MolecularWeight: 430.558623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C4SCCCS4)F

Isomeric SMILES

CC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C4SCCCS4)F

InChI

InChI=1S/C22H23FN2O2S2/c1-14-6-7-19(18(23)10-14)25-13-16(12-20(25)26)21(27)24-17-5-2-4-15(11-17)22-28-8-3-9-29-22/h2,4-7,10-11,16,22H,3,8-9,12-13H2,1H3,(H,24,27)