ethyl 2-[2-[(4E)-4-[(1-methylpyrazol-4-yl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(4E)-4-[(1-methylpyrazol-4-yl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(4E)-4-[(1-methylpyrazol-4-yl)methylene]-5-oxo-1-phenyl-imidazol-2-yl]sulfanylacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[(4E)-4-[(1-methyl-4-pyrazolyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4E)-4-[(1-methylpyrazol-4-yl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[[(4E)-5-keto-4-[(1-methylpyrazol-4-yl)methylene]-1-phenyl-2-imidazolin-2-yl]thio]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C29H25N5O4S2 MolecularWeight: 571.6699

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC(=CC4=CN(N=C4)C)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=N/C(=C/C4=CN(N=C4)C)/C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C29H25N5O4S2/c1-3-38-28(37)25-22(20-10-6-4-7-11-20)17-39-26(25)32-24(35)18-40-29-31-23(14-19-15-30-33(2)16-19)27(36)34(29)21-12-8-5-9-13-21/h4-17H,3,18H2,1-2H3,(H,32,35)/b23-14+