propan-2-yl 4-[(4E)-3-methyl-4-[(5-methylthiophen-2-yl)methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: propan-2-yl 4-[(4E)-3-methyl-4-[(5-methylthiophen-2-yl)methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: isopropyl 4-[(4E)-3-methyl-4-[(5-methyl-2-thienyl)methylene]-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-3-methyl-4-[(5-methyl-2-thiophenyl)methylidene]-5-oxo-1-pyrazolyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4E)-3-methyl-4-[(5-methylthiophen-2-yl)methylidene]-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-5-keto-3-methyl-4-[(5-methyl-2-thienyl)methylene]-2-pyrazolin-1-yl]benzoic acid isopropyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)C(=O)OC(C)C)C

Isomeric SMILES

CC1=CC=C(S1)/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)C(=O)OC(C)C)C

InChI

InChI=1S/C20H20N2O3S/c1-12(2)25-20(24)15-6-8-16(9-7-15)22-19(23)18(14(4)21-22)11-17-10-5-13(3)26-17/h5-12H,1-4H3/b18-11+