1-(1-adamantyl)-N-(4-cyano-2-phenyl-pyrazol-3-yl)-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-(4-cyano-2-phenyl-pyrazol-3-yl)-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-(4-cyano-2-phenyl-pyrazol-3-yl)-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-(4-cyano-2-phenyl-3-pyrazolyl)-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-(4-cyano-2-phenylpyrazol-3-yl)-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-(4-cyano-2-phenyl-pyrazol-3-yl)-4-nitro-pyrazole-3-carboxamide Formula: C24H23N7O3 MolecularWeight: 457.48452

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=C(C=NN5C6=CC=CC=C6)C#N)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=C(C=NN5C6=CC=CC=C6)C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H23N7O3/c25-12-18-13-26-30(19-4-2-1-3-5-19)22(18)27-23(32)21-20(31(33)34)14-29(28-21)24-9-15-6-16(10-24)8-17(7-15)11-24/h1-5,13-17H,6-11H2,(H,27,32)