5-ethyl-3-(2-methylpropyl)-N-(oxolan-2-ylmethyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-ethyl-3-(2-methylpropyl)-N-(oxolan-2-ylmethyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-ethyl-3-isobutyl-1-phenyl-N-(tetrahydrofuran-2-ylmethyl)pyrazole-4-carboxamide CAS Name: 5-ethyl-3-(2-methylpropyl)-N-(2-oxolanylmethyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-ethyl-3-(2-methylpropyl)-N-(oxolan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 5-ethyl-3-isobutyl-1-phenyl-N-(tetrahydrofurfuryl)pyrazole-4-carboxamide Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)NCC3CCCO3

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)NCC3CCCO3

InChI

InChI=1S/C21H29N3O2/c1-4-19-20(21(25)22-14-17-11-8-12-26-17)18(13-15(2)3)23-24(19)16-9-6-5-7-10-16/h5-7,9-10,15,17H,4,8,11-14H2,1-3H3,(H,22,25)