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

Systemtic Name: 3-(1-adamantyl)-N-butyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-butyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-butyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-butyl-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-butyl-1-phenyl-pyrazole-4-carboxamide Formula: C24H31N3O MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O/c1-2-3-9-25-23(28)21-16-27(20-7-5-4-6-8-20)26-22(21)24-13-17-10-18(14-24)12-19(11-17)15-24/h4-8,16-19H,2-3,9-15H2,1H3,(H,25,28)