2-[1-[2-(4-fluorophenyl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]sulfanyl-3-phenyl-imidazole-4-carboxylic acid

Systemtic Name: 2-[1-[2-(4-fluorophenyl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]sulfanyl-3-phenyl-imidazole-4-carboxylic acid Openeye Name: 2-[2-[2-(4-fluorobenzoyl)hydrazino]-1-methyl-2-oxo-ethyl]sulfanyl-3-phenyl-imidazole-4-carboxylic acid CAS Name: 2-[[1-[[(4-fluorophenyl)-oxomethyl]hydrazo]-1-oxopropan-2-yl]thio]-3-phenyl-4-imidazolecarboxylic acid IUPAC Name: 2-[1-[2-(4-fluorobenzoyl)hydrazinyl]-1-oxopropan-2-yl]sulfanyl-3-phenylimidazole-4-carboxylic acid Traditional Name: 2-[[2-[N'-(4-fluorobenzoyl)hydrazino]-2-keto-1-methyl-ethyl]thio]-3-phenyl-imidazole-4-carboxylic acid Formula: C20H17FN4O4S MolecularWeight: 428.436783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=CC=C(C=C1)F)SC2=NC=C(N2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C(=O)NNC(=O)C1=CC=C(C=C1)F)SC2=NC=C(N2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H17FN4O4S/c1-12(17(26)23-24-18(27)13-7-9-14(21)10-8-13)30-20-22-11-16(19(28)29)25(20)15-5-3-2-4-6-15/h2-12H,1H3,(H,23,26)(H,24,27)(H,28,29)