N-(1-adamantyl)-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29N3O/c1-18-24(26(31)28-27-15-19-12-20(16-27)14-21(13-19)17-27)25(22-8-4-2-5-9-22)29-30(18)23-10-6-3-7-11-23/h2-11,19-21H,12-17H2,1H3,(H,28,31)