(E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(4-ethylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(4-ethylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-N-(4-ethylsulfonylphenyl)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide CAS Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]-N-(4-ethylsulfonylphenyl)-2-propenamide IUPAC Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(4-ethylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(4-esylphenyl)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]acrylamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(N(C(=C2)C)C3=CC=NN3C(C)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=C(N(C(=C2)C)C3=CC=NN3C(C)C)C

InChI

InChI=1S/C23H28N4O3S/c1-6-31(29,30)21-10-8-20(9-11-21)25-22(28)12-7-19-15-17(4)26(18(19)5)23-13-14-24-27(23)16(2)3/h7-16H,6H2,1-5H3,(H,25,28)/b12-7+