N-(4-fluorophenyl)-5-[(4-nitroimidazol-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-5-[(4-nitroimidazol-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[(4-nitroimidazol-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-fluorophenyl)-5-[(4-nitro-1-imidazolyl)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-fluorophenyl)-5-[(4-nitroimidazol-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[(4-nitroimidazol-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C13H9FN6O3S MolecularWeight: 348.312363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NN=C(S2)CN3C=C(N=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NN=C(S2)CN3C=C(N=C3)[N+](=O)[O-])F

InChI

InChI=1S/C13H9FN6O3S/c14-8-1-3-9(4-2-8)16-12(21)13-18-17-11(24-13)6-19-5-10(15-7-19)20(22)23/h1-5,7H,6H2,(H,16,21)