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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-2-thioxo-N-veratryl-4-imidazoline-4-carboxamide Formula: C19H18FN3O3S MolecularWeight: 387.427923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C19H18FN3O3S/c1-25-16-8-3-12(9-17(16)26-2)10-21-18(24)15-11-22-19(27)23(15)14-6-4-13(20)5-7-14/h3-9,11H,10H2,1-2H3,(H,21,24)(H,22,27)