ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate

Systemtic Name: ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate Openeye Name: ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]acetate CAS Name: (2S)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]acetate Traditional Name: (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[[(E)-3-phenylacryloyl]amino]acetic acid ethyl ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N(N=C1C)C2=CC=CC=C2)C)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H](C1=C(N(N=C1C)C2=CC=CC=C2)C)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O3/c1-4-30-24(29)23(25-21(28)16-15-19-11-7-5-8-12-19)22-17(2)26-27(18(22)3)20-13-9-6-10-14-20/h5-16,23H,4H2,1-3H3,(H,25,28)/b16-15+/t23-/m0/s1