ethyl 3-oxidanylidene-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]butanoate

Systemtic Name: ethyl 3-oxidanylidene-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]butanoate Openeye Name: ethyl 3-oxo-2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]butanoate CAS Name: 3-oxo-2-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-2-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]butanoate Traditional Name: 2-acetyl-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylic acid ethyl ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C(=CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C20H18N2O3S/c1-3-25-20(24)17(14(2)23)12-15-13-22(16-8-5-4-6-9-16)21-19(15)18-10-7-11-26-18/h4-13H,3H2,1-2H3