3-(4-fluorophenyl)-2-sulfanylidene-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-sulfanylidene-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-2-thioxo-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-2-sulfanylidene-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole-4-carboxamide IUPAC Name: 3-(4-fluorophenyl)-2-sulfanylidene-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-2-thioxo-N-(3,4,5-trimethoxybenzyl)-4-imidazoline-4-carboxamide Formula: C20H20FN3O4S MolecularWeight: 417.453903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN3O4S/c1-26-16-8-12(9-17(27-2)18(16)28-3)10-22-19(25)15-11-23-20(29)24(15)14-6-4-13(21)5-7-14/h4-9,11H,10H2,1-3H3,(H,22,25)(H,23,29)