N'-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbohydrazide

Systemtic Name: N'-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbohydrazide Openeye Name: N'-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbohydrazide CAS Name: N'-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarbohydrazide IUPAC Name: N'-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbohydrazide Traditional Name: N'-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)-3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbohydrazide Formula: C20H17FN4O4S MolecularWeight: 428.436783

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NNC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NNC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H17FN4O4S/c1-30-20-22-10-14(25(20)13-8-6-12(21)7-9-13)18(26)23-24-19(27)17-11-28-15-4-2-3-5-16(15)29-17/h2-10,17H,11H2,1H3,(H,23,26)(H,24,27)