[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoate

Systemtic Name: [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoate Openeye Name: [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl] 3-(2-oxothiazolidin-3-yl)propanoate CAS Name: 3-(2-oxo-3-thiazolidinyl)propanoic acid [2-[(5-tert-butyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 3-(2-oxo-1,3-thiazolidin-3-yl)propanoate Traditional Name: 3-(2-ketothiazolidin-3-yl)propionic acid [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)COC(=O)CCN2CCSC2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)COC(=O)CCN2CCSC2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-21(2,3)16-13-17(25(23-16)15-7-5-4-6-8-15)22-18(26)14-29-19(27)9-10-24-11-12-30-20(24)28/h4-8,13H,9-12,14H2,1-3H3,(H,22,26)