2-(2-methylpropoxy)-5-[5-(2-methylpyridin-4-yl)-1H-1,2,4-triazol-3-yl]benzenecarbonitrile

Systemtic Name: 2-(2-methylpropoxy)-5-[5-(2-methylpyridin-4-yl)-1H-1,2,4-triazol-3-yl]benzenecarbonitrile Openeye Name: 2-isobutoxy-5-[5-(2-methyl-4-pyridyl)-1H-1,2,4-triazol-3-yl]benzonitrile CAS Name: 2-(2-methylpropoxy)-5-[5-(2-methyl-4-pyridinyl)-1H-1,2,4-triazol-3-yl]benzonitrile IUPAC Name: 2-(2-methylpropoxy)-5-[5-(2-methylpyridin-4-yl)-1H-1,2,4-triazol-3-yl]benzonitrile Traditional Name: 2-isobutoxy-5-[5-(2-methyl-4-pyridyl)-1H-1,2,4-triazol-3-yl]benzonitrile Formula: C19H19N5O MolecularWeight: 333.38706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=NC(=NN2)C3=CC(=C(C=C3)OCC(C)C)C#N

Isomeric SMILES

CC1=NC=CC(=C1)C2=NC(=NN2)C3=CC(=C(C=C3)OCC(C)C)C#N

InChI

InChI=1S/C19H19N5O/c1-12(2)11-25-17-5-4-14(9-16(17)10-20)18-22-19(24-23-18)15-6-7-21-13(3)8-15/h4-9,12H,11H2,1-3H3,(H,22,23,24)