N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-(3-ethynylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C18H14N4O MolecularWeight: 302.32996

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H14N4O/c1-2-14-4-3-5-17(10-14)21-18(23)16-8-6-15(7-9-16)11-22-13-19-12-20-22/h1,3-10,12-13H,11H2,(H,21,23)