3-(2-methylphenyl)-1-phenyl-N-prop-2-ynyl-pyrazole-4-carboxamide

Systemtic Name: 3-(2-methylphenyl)-1-phenyl-N-prop-2-ynyl-pyrazole-4-carboxamide Openeye Name: 3-(o-tolyl)-1-phenyl-N-prop-2-ynyl-pyrazole-4-carboxamide CAS Name: 3-(2-methylphenyl)-1-phenyl-N-prop-2-ynyl-4-pyrazolecarboxamide IUPAC Name: 3-(2-methylphenyl)-1-phenyl-N-prop-2-ynylpyrazole-4-carboxamide Traditional Name: 3-(o-tolyl)-1-phenyl-N-propargyl-pyrazole-4-carboxamide Formula: C20H17N3O MolecularWeight: 315.36848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCC#C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCC#C)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O/c1-3-13-21-20(24)18-14-23(16-10-5-4-6-11-16)22-19(18)17-12-8-7-9-15(17)2/h1,4-12,14H,13H2,2H3,(H,21,24)