(E)-2-cyano-N-(2,4-dichlorophenyl)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,4-dichlorophenyl)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,4-dichlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,4-dichlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,4-dichlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,4-dichlorophenyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acrylamide Formula: C21H16Cl2N4O2 MolecularWeight: 427.28334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=C(C#N)C(=O)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)/C=C(\C#N)/C(=O)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H16Cl2N4O2/c1-13-17(21(29)27(26(13)2)16-6-4-3-5-7-16)10-14(12-24)20(28)25-19-9-8-15(22)11-18(19)23/h3-11H,1-2H3,(H,25,28)/b14-10+