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

Systemtic Name: 5-methyl-3-(2-methylpropyl)-N-(oxolan-2-ylmethyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-isobutyl-5-methyl-1-phenyl-N-(tetrahydrofuran-2-ylmethyl)pyrazole-4-carboxamide CAS Name: 5-methyl-3-(2-methylpropyl)-N-(2-oxolanylmethyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-methyl-3-(2-methylpropyl)-N-(oxolan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-isobutyl-5-methyl-1-phenyl-N-(tetrahydrofurfuryl)pyrazole-4-carboxamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)NCC3CCCO3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)CC(C)C)C(=O)NCC3CCCO3

InChI

InChI=1S/C20H27N3O2/c1-14(2)12-18-19(20(24)21-13-17-10-7-11-25-17)15(3)23(22-18)16-8-5-4-6-9-16/h4-6,8-9,14,17H,7,10-13H2,1-3H3,(H,21,24)