N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide Openeye Name: N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide CAS Name: N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)-3-pyridinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide Traditional Name: N-(3-ethynylphenyl)-2-(1,2,4-triazol-1-yl)nicotinamide Formula: C16H11N5O MolecularWeight: 289.29144

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3C=NC=N3

InChI

InChI=1S/C16H11N5O/c1-2-12-5-3-6-13(9-12)20-16(22)14-7-4-8-18-15(14)21-11-17-10-19-21/h1,3-11H,(H,20,22)