(E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-2-(3-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-2-(3-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(3-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]-2-[(3-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-2-(3-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]-2-m-toluoyl-acrylonitrile Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=NN3C(C)C)C)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C/C2=C(N(C(=C2)C)C3=CC=NN3C(C)C)C)/C#N

InChI

InChI=1S/C23H24N4O/c1-15(2)27-22(9-10-25-27)26-17(4)12-20(18(26)5)13-21(14-24)23(28)19-8-6-7-16(3)11-19/h6-13,15H,1-5H3/b21-13+