N-(3-ethynylphenyl)-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-ethynylphenyl)-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(3-ethynylphenyl)-3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3-ethynylphenyl)-3,5-dimethylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3-ethynylphenyl)-3,5-dimethyl-pyrazole-4-carboxamide Formula: C21H19N3O MolecularWeight: 329.39506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C21H19N3O/c1-4-17-11-8-12-19(13-17)22-21(25)20-15(2)23-24(16(20)3)14-18-9-6-5-7-10-18/h1,5-13H,14H2,2-3H3,(H,22,25)