N'-(1-adamantylcarbonyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carbohydrazide

Systemtic Name: N'-(1-adamantylcarbonyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carbohydrazide Openeye Name: N'-(adamantane-1-carbonyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carbohydrazide CAS Name: N'-[1-adamantyl(oxo)methyl]-5-[[(1-methyl-2-imidazolyl)thio]methyl]-2-furancarbohydrazide IUPAC Name: N'-(adamantane-1-carbonyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carbohydrazide Traditional Name: N'-(adamantane-1-carbonyl)-5-[[(1-methylimidazol-2-yl)thio]methyl]-2-furohydrazide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CC=C(O2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C=CN=C1SCC2=CC=C(O2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N4O3S/c1-25-5-4-22-20(25)29-12-16-2-3-17(28-16)18(26)23-24-19(27)21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,13-15H,6-12H2,1H3,(H,23,26)(H,24,27)