ethyl (2S)-2-(cyclobutylcarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate

Systemtic Name: ethyl (2S)-2-(cyclobutylcarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate Openeye Name: ethyl (2S)-2-(cyclobutanecarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetate CAS Name: (2S)-2-[[cyclobutyl(oxo)methyl]amino]-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(cyclobutanecarbonylamino)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetate Traditional Name: (2S)-2-(cyclobutanecarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetic acid ethyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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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)C3CCC3

Isomeric SMILES

CCOC(=O)[C@H](C1=C(N(N=C1C)C2=CC=CC=C2)C)NC(=O)C3CCC3

InChI

InChI=1S/C20H25N3O3/c1-4-26-20(25)18(21-19(24)15-9-8-10-15)17-13(2)22-23(14(17)3)16-11-6-5-7-12-16/h5-7,11-12,15,18H,4,8-10H2,1-3H3,(H,21,24)/t18-/m0/s1