3-(4-fluorophenyl)-N-(1-methylpyrazol-3-yl)-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-(1-methylpyrazol-3-yl)-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-(1-methylpyrazol-3-yl)-2-thioxo-1H-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-(1-methyl-3-pyrazolyl)-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: 3-(4-fluorophenyl)-N-(1-methylpyrazol-3-yl)-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(1-methylpyrazol-3-yl)-2-thioxo-4-imidazoline-4-carboxamide Formula: C14H12FN5OS MolecularWeight: 317.341383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

InChI

InChI=1S/C14H12FN5OS/c1-19-7-6-12(18-19)17-13(21)11-8-16-14(22)20(11)10-4-2-9(15)3-5-10/h2-8H,1H3,(H,16,22)(H,17,18,21)