3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-N-[2-propoxy-5-(trifluoromethyl)phenyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)-N-[2-propoxy-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide Formula: C21H19F4N3O2S MolecularWeight: 453.453073

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H19F4N3O2S/c1-3-10-30-18-9-4-13(21(23,24)25)11-16(18)27-19(29)17-12-26-20(31-2)28(17)15-7-5-14(22)6-8-15/h4-9,11-12H,3,10H2,1-2H3,(H,27,29)