ethyl 2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-ethylsulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-ethylsulfonyl-amino]ethanoate Openeye Name: ethyl 2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-ethylsulfonyl-amino]acetate CAS Name: 2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-ethylsulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-ethylsulfonylamino]acetate Traditional Name: 2-[esyl-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]acetic acid ethyl ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)CN(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)S(=O)(=O)CC

InChI

InChI=1S/C17H23N3O5S/c1-5-25-15(21)12-19(26(23,24)6-2)16-13(3)18(4)20(17(16)22)14-10-8-7-9-11-14/h7-11H,5-6,12H2,1-4H3