3-(4-fluorophenyl)-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-2-sulfanylidene-1H-imidazole-4-carbohydrazide

Systemtic Name: 3-(4-fluorophenyl)-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-2-sulfanylidene-1H-imidazole-4-carbohydrazide Openeye Name: 3-(4-fluorophenyl)-N'-[2-(2-oxoazepan-1-yl)acetyl]-2-thioxo-1H-imidazole-4-carbohydrazide CAS Name: 3-(4-fluorophenyl)-N'-[1-oxo-2-(2-oxo-1-azepanyl)ethyl]-2-sulfanylidene-1H-imidazole-4-carbohydrazide IUPAC Name: 3-(4-fluorophenyl)-N'-[2-(2-oxoazepan-1-yl)acetyl]-2-sulfanylidene-1H-imidazole-4-carbohydrazide Traditional Name: 3-(4-fluorophenyl)-N'-[2-(2-ketoazepan-1-yl)acetyl]-2-thioxo-4-imidazoline-4-carbohydrazide Formula: C18H20FN5O3S MolecularWeight: 405.446503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN5O3S/c19-12-5-7-13(8-6-12)24-14(10-20-18(24)28)17(27)22-21-15(25)11-23-9-3-1-2-4-16(23)26/h5-8,10H,1-4,9,11H2,(H,20,28)(H,21,25)(H,22,27)