N-(1-adamantyl)-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-1,3-diphenyl-pyrazole-4-carboxamide Formula: C26H27N3O MolecularWeight: 397.51208

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H27N3O/c30-25(27-26-14-18-11-19(15-26)13-20(12-18)16-26)23-17-29(22-9-5-2-6-10-22)28-24(23)21-7-3-1-4-8-21/h1-10,17-20H,11-16H2,(H,27,30)