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

Systemtic Name: 3-(1-adamantyl)-N-ethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-ethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-ethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-ethyl-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-ethyl-1-phenyl-pyrazole-4-carboxamide Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(N=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

Isomeric SMILES

CCNC(=O)C1=CN(N=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

InChI

InChI=1S/C22H27N3O/c1-2-23-21(26)19-14-25(18-6-4-3-5-7-18)24-20(19)22-11-15-8-16(12-22)10-17(9-15)13-22/h3-7,14-17H,2,8-13H2,1H3,(H,23,26)