(E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclopropyl-3-[3-(4-ethylphenyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C24H22N4O MolecularWeight: 382.45768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H22N4O/c1-2-17-8-10-18(11-9-17)23-20(14-19(15-25)24(29)26-21-12-13-21)16-28(27-23)22-6-4-3-5-7-22/h3-11,14,16,21H,2,12-13H2,1H3,(H,26,29)/b19-14+