N-[(E)-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]methylideneamino]pyridine-3-carboxamide

Systemtic Name: N-[(E)-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]methylideneamino]pyridine-3-carboxamide Openeye Name: N-[(E)-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]methyleneamino]pyridine-3-carboxamide CAS Name: N-[(E)-[3-(1-adamantyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]methylideneamino]pyridine-3-carboxamide Traditional Name: N-[(E)-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]methyleneamino]nicotinamide Formula: C26H27N5O MolecularWeight: 425.52548

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C=NNC(=O)C5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4/C=N/NC(=O)C5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H27N5O/c32-25(21-5-4-8-27-15-21)29-28-16-22-17-31(23-6-2-1-3-7-23)30-24(22)26-12-18-9-19(13-26)11-20(10-18)14-26/h1-8,15-20H,9-14H2,(H,29,32)/b28-16+