3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide

Systemtic Name: 3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide Openeye Name: 3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide CAS Name: 3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide IUPAC Name: 3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide Traditional Name: 3-cyano-N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]benzamide Formula: C18H15N5O3 MolecularWeight: 349.3434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=CC(=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=CC(=C3)C#N)OC

InChI

InChI=1S/C18H15N5O3/c1-25-14-7-6-12(9-15(14)26-2)16-20-18(23-22-16)21-17(24)13-5-3-4-11(8-13)10-19/h3-9H,1-2H3,(H2,20,21,22,23,24)