(E)-3-[5-chloranyl-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-(furan-2-ylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-chloranyl-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-(furan-2-ylcarbonyl)prop-2-enenitrile Openeye Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-(furan-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-4-pyrazolyl]-2-[2-furanyl(oxo)methyl]-2-propenenitrile IUPAC Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methylpyrazol-4-yl]-2-(furan-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-(2-furoyl)acrylonitrile Formula: C20H16ClN3O2 MolecularWeight: 365.81294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)C=C(C#N)C(=O)C3=CC=CO3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)/C=C(\C#N)/C(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C20H16ClN3O2/c1-12-6-7-13(2)17(9-12)24-20(21)16(14(3)23-24)10-15(11-22)19(25)18-5-4-8-26-18/h4-10H,1-3H3/b15-10+