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

Systemtic Name: 3-[1-[3,5-bis(fluoranyl)phenyl]propyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid Openeye Name: 3-[1-(3,5-difluorophenyl)propyl]-2-thioxo-1H-imidazole-4-carboxylic acid CAS Name: 3-[1-(3,5-difluorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid IUPAC Name: 3-[1-(3,5-difluorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid Traditional Name: 3-[1-(3,5-difluorophenyl)propyl]-2-thioxo-4-imidazoline-4-carboxylic acid Formula: C13H12F2N2O2S MolecularWeight: 298.308386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC(=C1)F)F)N2C(=CNC2=S)C(=O)O

Isomeric SMILES

CCC(C1=CC(=CC(=C1)F)F)N2C(=CNC2=S)C(=O)O

InChI

InChI=1S/C13H12F2N2O2S/c1-2-10(7-3-8(14)5-9(15)4-7)17-11(12(18)19)6-16-13(17)20/h3-6,10H,2H2,1H3,(H,16,20)(H,18,19)