2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylene]-5-oxo-imidazol-2-yl]sulfanyl-N-(4-nitrophenyl)acetamide CAS Name: 2-[[(4E)-1-cyclohexyl-4-[(1,3-dimethyl-4-pyrazolyl)methylidene]-5-oxo-2-imidazolyl]thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylidene]-5-oxoimidazol-2-yl]sulfanyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-[[(4E)-1-cyclohexyl-4-[(1,3-dimethylpyrazol-4-yl)methylene]-5-keto-2-imidazolin-2-yl]thio]-N-(4-nitrophenyl)acetamide Formula: C23H26N6O4S MolecularWeight: 482.55534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C=C2C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C4CCCCC4)C

Isomeric SMILES

CC1=NN(C=C1/C=C/2\C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C4CCCCC4)C

InChI

InChI=1S/C23H26N6O4S/c1-15-16(13-27(2)26-15)12-20-22(31)28(18-6-4-3-5-7-18)23(25-20)34-14-21(30)24-17-8-10-19(11-9-17)29(32)33/h8-13,18H,3-7,14H2,1-2H3,(H,24,30)/b20-12+