(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2-oxothiazolidin-3-yl)propanoate CAS Name: 3-(2-oxo-3-thiazolidinyl)propanoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 3-(2-oxo-1,3-thiazolidin-3-yl)propanoate Traditional Name: 3-(2-ketothiazolidin-3-yl)propionic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)CCN2CCSC2=O)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)CCN2CCSC2=O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H18ClN3O3S/c1-12-14(16(18)21(19-12)13-5-3-2-4-6-13)11-24-15(22)7-8-20-9-10-25-17(20)23/h2-6H,7-11H2,1H3