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

Systemtic Name: ethyl 2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methylsulfonyl-amino]ethanoate Openeye Name: ethyl 2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-methylsulfonyl-amino]acetate CAS Name: 2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-methylsulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylsulfonylamino]acetate Traditional Name: 2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-mesyl-amino]acetic acid ethyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O5S/c1-5-24-14(20)11-18(25(4,22)23)15-12(2)17(3)19(16(15)21)13-9-7-6-8-10-13/h6-10H,5,11H2,1-4H3