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

Systemtic Name: 2-[(4E)-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-1-ethyl-5-oxidanylidene-imidazol-2-yl]sulfanylethanamide Openeye Name: 2-[(4E)-4-[(1,3-dimethylpyrazol-4-yl)methylene]-1-ethyl-5-oxo-imidazol-2-yl]sulfanylacetamide CAS Name: 2-[[(4E)-4-[(1,3-dimethyl-4-pyrazolyl)methylidene]-1-ethyl-5-oxo-2-imidazolyl]thio]acetamide IUPAC Name: 2-[(4E)-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-1-ethyl-5-oxoimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[[(4E)-4-[(1,3-dimethylpyrazol-4-yl)methylene]-1-ethyl-5-keto-2-imidazolin-2-yl]thio]acetamide Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CN(N=C2C)C)N=C1SCC(=O)N

Isomeric SMILES

CCN1C(=O)/C(=C\C2=CN(N=C2C)C)/N=C1SCC(=O)N

InChI

InChI=1S/C13H17N5O2S/c1-4-18-12(20)10(15-13(18)21-7-11(14)19)5-9-6-17(3)16-8(9)2/h5-6H,4,7H2,1-3H3,(H2,14,19)/b10-5+