2-[4-[6-(3-ethanoylphenyl)pyridin-3-yl]-3-(3-methoxy-5-methyl-phenyl)pyrazol-1-yl]ethanenitrile

Systemtic Name: 2-[4-[6-(3-ethanoylphenyl)pyridin-3-yl]-3-(3-methoxy-5-methyl-phenyl)pyrazol-1-yl]ethanenitrile Openeye Name: 2-[4-[6-(3-acetylphenyl)-3-pyridyl]-3-(3-methoxy-5-methyl-phenyl)pyrazol-1-yl]acetonitrile CAS Name: 2-[4-[6-(3-acetylphenyl)-3-pyridinyl]-3-(3-methoxy-5-methylphenyl)-1-pyrazolyl]acetonitrile IUPAC Name: 2-[4-[6-(3-acetylphenyl)pyridin-3-yl]-3-(3-methoxy-5-methylphenyl)pyrazol-1-yl]acetonitrile Traditional Name: 2-[4-[6-(3-acetylphenyl)-3-pyridyl]-3-(3-methoxy-5-methyl-phenyl)pyrazol-1-yl]acetonitrile Formula: C26H22N4O2 MolecularWeight: 422.47848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN(C=C2C3=CN=C(C=C3)C4=CC(=CC=C4)C(=O)C)CC#N)OC

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN(C=C2C3=CN=C(C=C3)C4=CC(=CC=C4)C(=O)C)CC#N)OC

InChI

InChI=1S/C26H22N4O2/c1-17-11-22(14-23(12-17)32-3)26-24(16-30(29-26)10-9-27)21-7-8-25(28-15-21)20-6-4-5-19(13-20)18(2)31/h4-8,11-16H,10H2,1-3H3