3-[[3,5-bis(fluoranyl)phenyl]methyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid

Systemtic Name: 3-[[3,5-bis(fluoranyl)phenyl]methyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid Openeye Name: 3-[(3,5-difluorophenyl)methyl]-2-thioxo-1H-imidazole-4-carboxylic acid CAS Name: 3-[(3,5-difluorophenyl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid IUPAC Name: 3-[(3,5-difluorophenyl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid Traditional Name: 3-(3,5-difluorobenzyl)-2-thioxo-4-imidazoline-4-carboxylic acid Formula: C11H8F2N2O2S MolecularWeight: 270.255226

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)CN2C(=CNC2=S)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1F)F)CN2C(=CNC2=S)C(=O)O

InChI

InChI=1S/C11H8F2N2O2S/c12-7-1-6(2-8(13)3-7)5-15-9(10(16)17)4-14-11(15)18/h1-4H,5H2,(H,14,18)(H,16,17)