4-(3-cyanopropoxy)-N-(5-cyano-3-pyridin-3-yl-1,2,4-triazol-1-yl)benzamide

Systemtic Name: 4-(3-cyanopropoxy)-N-(5-cyano-3-pyridin-3-yl-1,2,4-triazol-1-yl)benzamide Openeye Name: 4-(3-cyanopropoxy)-N-[5-cyano-3-(3-pyridyl)-1,2,4-triazol-1-yl]benzamide CAS Name: 4-(3-cyanopropoxy)-N-[5-cyano-3-(3-pyridinyl)-1,2,4-triazol-1-yl]benzamide IUPAC Name: 4-(3-cyanopropoxy)-N-(5-cyano-3-pyridin-3-yl-1,2,4-triazol-1-yl)benzamide Traditional Name: 4-(3-cyanopropoxy)-N-[5-cyano-3-(3-pyridyl)-1,2,4-triazol-1-yl]benzamide Formula: C19H15N7O2 MolecularWeight: 373.3681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=N2)C#N)NC(=O)C3=CC=C(C=C3)OCCCC#N

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=N2)C#N)NC(=O)C3=CC=C(C=C3)OCCCC#N

InChI

InChI=1S/C19H15N7O2/c20-9-1-2-11-28-16-7-5-14(6-8-16)19(27)25-26-17(12-21)23-18(24-26)15-4-3-10-22-13-15/h3-8,10,13H,1-2,11H2,(H,25,27)