methyl 2-acetamido-6-[2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 2-acetamido-6-[2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 2-acetamido-6-[2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-4-oxo-thiazolidin-3-yl]hexanoate CAS Name: 2-acetamido-6-[2-(5-chloro-1,3-dimethyl-4-pyrazolyl)-4-oxo-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-4-oxo-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 2-acetamido-6-[2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-4-keto-thiazolidin-3-yl]hexanoic acid methyl ester Formula: C17H25ClN4O4S MolecularWeight: 416.9228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2N(C(=O)CS2)CCCCC(C(=O)OC)NC(=O)C)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C2N(C(=O)CS2)CCCCC(C(=O)OC)NC(=O)C)Cl)C

InChI

InChI=1S/C17H25ClN4O4S/c1-10-14(15(18)21(3)20-10)16-22(13(24)9-27-16)8-6-5-7-12(17(25)26-4)19-11(2)23/h12,16H,5-9H2,1-4H3,(H,19,23)