3-[3-ethyl-5-(6-phenylpyridin-3-yl)-1,2,4-triazol-4-yl]-2-methyl-benzamide

Systemtic Name: 3-[3-ethyl-5-(6-phenylpyridin-3-yl)-1,2,4-triazol-4-yl]-2-methyl-benzamide Openeye Name: 3-[3-ethyl-5-(6-phenyl-3-pyridyl)-1,2,4-triazol-4-yl]-2-methyl-benzamide CAS Name: 3-[3-ethyl-5-(6-phenyl-3-pyridinyl)-1,2,4-triazol-4-yl]-2-methylbenzamide IUPAC Name: 3-[3-ethyl-5-(6-phenylpyridin-3-yl)-1,2,4-triazol-4-yl]-2-methylbenzamide Traditional Name: 3-[3-ethyl-5-(6-phenyl-3-pyridyl)-1,2,4-triazol-4-yl]-2-methyl-benzamide Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC(=C2C)C(=O)N)C3=CN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC(=C2C)C(=O)N)C3=CN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N5O/c1-3-21-26-27-23(28(21)20-11-7-10-18(15(20)2)22(24)29)17-12-13-19(25-14-17)16-8-5-4-6-9-16/h4-14H,3H2,1-2H3,(H2,24,29)