3-(4-fluorophenyl)-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-methylsulfanylimidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-2-(methylthio)imidazole-4-carboxamide Formula: C22H21FN4O3S MolecularWeight: 440.490543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC)N4CCCC4=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC)N4CCCC4=O

InChI

InChI=1S/C22H21FN4O3S/c1-30-19-12-15(7-10-17(19)26-11-3-4-20(26)28)25-21(29)18-13-24-22(31-2)27(18)16-8-5-14(23)6-9-16/h5-10,12-13H,3-4,11H2,1-2H3,(H,25,29)