ethyl 1-[(5Z)-5-[(1,3-dimethylpyrazol-4-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(5Z)-5-[(1,3-dimethylpyrazol-4-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(5Z)-5-[(1,3-dimethylpyrazol-4-yl)methylene]-4-oxo-thiazol-2-yl]piperidine-4-carboxylate CAS Name: 1-[(5Z)-5-[(1,3-dimethyl-4-pyrazolyl)methylidene]-4-oxo-2-thiazolyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(5Z)-5-[(1,3-dimethylpyrazol-4-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]piperidine-4-carboxylate Traditional Name: 1-[(5Z)-5-[(1,3-dimethylpyrazol-4-yl)methylene]-4-keto-2-thiazolin-2-yl]isonipecotic acid ethyl ester Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC(=O)C(=CC3=CN(N=C3C)C)S2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC(=O)/C(=C/C3=CN(N=C3C)C)/S2

InChI

InChI=1S/C17H22N4O3S/c1-4-24-16(23)12-5-7-21(8-6-12)17-18-15(22)14(25-17)9-13-10-20(3)19-11(13)2/h9-10,12H,4-8H2,1-3H3/b14-9-