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

Systemtic Name: ethyl 2-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxo-thiazolidin-3-yl]acetyl]amino]acetate CAS Name: 2-[[2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-oxo-3-thiazolidinyl]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-oxo-1,3-thiazolidin-3-yl]acetyl]amino]acetate Traditional Name: 2-[[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-keto-thiazolidin-3-yl]acetyl]amino]acetic acid ethyl ester Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CN1C(SCC1=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)CNC(=O)CN1C(SCC1=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H24N4O4S/c1-4-28-18(27)10-21-16(25)11-23-17(26)12-29-20(23)19-13(2)22-24(14(19)3)15-8-6-5-7-9-15/h5-9,20H,4,10-12H2,1-3H3,(H,21,25)