ethyl 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylene]-5-oxo-imidazol-2-yl]sulfanylacetate CAS Name: 2-[[(4E)-1-cyclohexyl-4-[(1,3-dimethyl-4-pyrazolyl)methylidene]-5-oxo-2-imidazolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxoimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylene]-5-keto-2-imidazolin-2-yl]thio]acetic acid ethyl ester Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=CC2=CN(N=C2C)C)C(=O)N1C3CCCCC3

Isomeric SMILES

CCOC(=O)CSC1=N/C(=C/C2=CN(N=C2C)C)/C(=O)N1C3CCCCC3

InChI

InChI=1S/C19H26N4O3S/c1-4-26-17(24)12-27-19-20-16(10-14-11-22(3)21-13(14)2)18(25)23(19)15-8-6-5-7-9-15/h10-11,15H,4-9,12H2,1-3H3/b16-10+