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

Systemtic Name: N-(3-ethynylphenyl)-1,3,5-trimethyl-pyrazole-4-carboxamide Openeye Name: N-(3-ethynylphenyl)-1,3,5-trimethyl-pyrazole-4-carboxamide CAS Name: N-(3-ethynylphenyl)-1,3,5-trimethyl-4-pyrazolecarboxamide IUPAC Name: N-(3-ethynylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide Traditional Name: N-(3-ethynylphenyl)-1,3,5-trimethyl-pyrazole-4-carboxamide Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C15H15N3O/c1-5-12-7-6-8-13(9-12)16-15(19)14-10(2)17-18(4)11(14)3/h1,6-9H,2-4H3,(H,16,19)