3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: 3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: 3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: 3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: 3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: 3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-isopropyl-acrylamide Formula: C17H17ClN4O MolecularWeight: 328.79608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C(=O)NC(C)C)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C=C(C#N)C(=O)NC(C)C)Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H17ClN4O/c1-11(2)20-17(23)13(10-19)9-15-12(3)21-22(16(15)18)14-7-5-4-6-8-14/h4-9,11H,1-3H3,(H,20,23)