3-(1-adamantyl)-N-(4-ethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-(4-ethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-(4-ethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-(4-ethoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-(4-ethoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-1-phenyl-N-p-phenetyl-pyrazole-4-carboxamide Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C28H31N3O2/c1-2-33-24-10-8-22(9-11-24)29-27(32)25-18-31(23-6-4-3-5-7-23)30-26(25)28-15-19-12-20(16-28)14-21(13-19)17-28/h3-11,18-21H,2,12-17H2,1H3,(H,29,32)