N'-[(E)-[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]adamantane-1-carbohydrazide

Systemtic Name: N'-[(E)-[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]adamantane-1-carbohydrazide Openeye Name: N'-[(E)-[3-methyl-5-oxo-1-(p-tolyl)pyrazol-4-ylidene]methyl]adamantane-1-carbohydrazide CAS Name: N'-[(E)-[3-methyl-1-(4-methylphenyl)-5-oxo-4-pyrazolylidene]methyl]-1-adamantanecarbohydrazide IUPAC Name: N'-[(E)-[3-methyl-1-(4-methylphenyl)-5-oxopyrazol-4-ylidene]methyl]adamantane-1-carbohydrazide Traditional Name: N'-[(E)-[5-keto-3-methyl-1-(p-tolyl)-2-pyrazolin-4-ylidene]methyl]adamantane-1-carbohydrazide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CNNC(=O)C34CC5CC(C3)CC(C5)C4)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/NNC(=O)C34CC5CC(C3)CC(C5)C4)/C(=N2)C

InChI

InChI=1S/C23H28N4O2/c1-14-3-5-19(6-4-14)27-21(28)20(15(2)26-27)13-24-25-22(29)23-10-16-7-17(11-23)9-18(8-16)12-23/h3-6,13,16-18,24H,7-12H2,1-2H3,(H,25,29)/b20-13+