3-(4-fluorophenyl)-2-methylsulfanyl-N'-(3,4,5-trimethoxyphenyl)carbonyl-imidazole-4-carbohydrazide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N'-(3,4,5-trimethoxyphenyl)carbonyl-imidazole-4-carbohydrazide Openeye Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N'-(3,4,5-trimethoxybenzoyl)imidazole-4-carbohydrazide CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-N'-[oxo-(3,4,5-trimethoxyphenyl)methyl]-4-imidazolecarbohydrazide IUPAC Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N'-(3,4,5-trimethoxybenzoyl)imidazole-4-carbohydrazide Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)-N'-(3,4,5-trimethoxybenzoyl)imidazole-4-carbohydrazide Formula: C21H21FN4O5S MolecularWeight: 460.478643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H21FN4O5S/c1-29-16-9-12(10-17(30-2)18(16)31-3)19(27)24-25-20(28)15-11-23-21(32-4)26(15)14-7-5-13(22)6-8-14/h5-11H,1-4H3,(H,24,27)(H,25,28)