N'-(4-tert-butylphenyl)carbonyl-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carbohydrazide

Systemtic Name: N'-(4-tert-butylphenyl)carbonyl-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carbohydrazide Openeye Name: N'-(4-tert-butylbenzoyl)-3-(4-fluorophenyl)-2-thioxo-1H-imidazole-4-carbohydrazide CAS Name: N'-[(4-tert-butylphenyl)-oxomethyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carbohydrazide IUPAC Name: N'-(4-tert-butylbenzoyl)-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carbohydrazide Traditional Name: N'-(4-tert-butylbenzoyl)-3-(4-fluorophenyl)-2-thioxo-4-imidazoline-4-carbohydrazide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O2S/c1-21(2,3)14-6-4-13(5-7-14)18(27)24-25-19(28)17-12-23-20(29)26(17)16-10-8-15(22)9-11-16/h4-12H,1-3H3,(H,23,29)(H,24,27)(H,25,28)