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

Systemtic Name: 2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylene]-5-oxo-imidazol-2-yl]sulfanyl-acetamide CAS Name: 2-[[(4E)-1-ethyl-4-[(1-ethyl-4-pyrazolyl)methylidene]-5-oxo-2-imidazolyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylidene]-5-oxoimidazol-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[(4E)-1-ethyl-4-[(1-ethylpyrazol-4-yl)methylene]-5-keto-2-imidazolin-2-yl]thio]acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C=C2C(=O)N(C(=N2)SCC(=O)NCC3=CC=CC=C3)CC

Isomeric SMILES

CCN1C=C(C=N1)/C=C/2\C(=O)N(C(=N2)SCC(=O)NCC3=CC=CC=C3)CC

InChI

InChI=1S/C20H23N5O2S/c1-3-24-13-16(12-22-24)10-17-19(27)25(4-2)20(23-17)28-14-18(26)21-11-15-8-6-5-7-9-15/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,21,26)/b17-10+