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

Systemtic Name: (E)-N-butyl-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-butyl-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enamide CAS Name: (E)-N-butyl-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-butyl-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-butyl-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-acrylamide Formula: C18H19ClN4O MolecularWeight: 342.82266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=C(N(N=C1C)C2=CC=CC=C2)Cl)/C#N

InChI

InChI=1S/C18H19ClN4O/c1-3-4-10-21-18(24)14(12-20)11-16-13(2)22-23(17(16)19)15-8-6-5-7-9-15/h5-9,11H,3-4,10H2,1-2H3,(H,21,24)/b14-11+