N-(2,5-dimethylphenyl)-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylene]-5-oxo-imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[(4E)-1-ethyl-4-[(1-ethyl-4-pyrazolyl)methylidene]-5-oxo-2-imidazolyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylidene]-5-oxoimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylene]-5-keto-2-imidazolin-2-yl]thio]acetamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C=C2C(=O)N(C(=N2)SCC(=O)NC3=C(C=CC(=C3)C)C)CC

Isomeric SMILES

CCN1C=C(C=N1)/C=C/2\C(=O)N(C(=N2)SCC(=O)NC3=C(C=CC(=C3)C)C)CC

InChI

InChI=1S/C21H25N5O2S/c1-5-25-12-16(11-22-25)10-18-20(28)26(6-2)21(24-18)29-13-19(27)23-17-9-14(3)7-8-15(17)4/h7-12H,5-6,13H2,1-4H3,(H,23,27)/b18-10+