3-methyl-N-(2-methylpropyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-methyl-N-(2-methylpropyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-isobutyl-3-methyl-pyrazole-4-carboxamide CAS Name: 3-methyl-N-(2-methylpropyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-methyl-N-(2-methylpropyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-isobutyl-3-methyl-pyrazole-4-carboxamide Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)NCC(C)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C=C1C(=O)NCC(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O/c1-12(2)9-17-16(20)15-11-19(18-13(15)3)10-14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3,(H,17,20)