(E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-3-[3,5-dimethyl-1-(p-tolylmethyl)pyrazol-4-yl]-N-(3-pyridyl)prop-2-enamide CAS Name: (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-N-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-N-pyridin-3-ylprop-2-enamide Traditional Name: (E)-3-[3,5-dimethyl-1-(4-methylbenzyl)pyrazol-4-yl]-N-(3-pyridyl)acrylamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)NC3=CN=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C/C(=O)NC3=CN=CC=C3)C

InChI

InChI=1S/C21H22N4O/c1-15-6-8-18(9-7-15)14-25-17(3)20(16(2)24-25)10-11-21(26)23-19-5-4-12-22-13-19/h4-13H,14H2,1-3H3,(H,23,26)/b11-10+