ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: ethyl (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(3-methylbenzoyl)amino]acetate CAS Name: (2S)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-[(3-methylbenzoyl)amino]acetate Traditional Name: (2S)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(m-toluoylamino)acetic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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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)C3=CC(=CC=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O3/c1-5-29-23(28)21(24-22(27)18-11-9-10-15(2)14-18)20-16(3)25-26(17(20)4)19-12-7-6-8-13-19/h6-14,21H,5H2,1-4H3,(H,24,27)/t21-/m0/s1