ethyl 2-[(4E)-4-[(2-ethoxyphenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4E)-4-[(2-ethoxyphenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4E)-4-[(2-ethoxyphenyl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(4E)-4-[(2-ethoxyphenyl)methylidene]-3-methyl-5-oxo-1-pyrazolyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4E)-4-[(2-ethoxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4E)-4-(2-ethoxybenzylidene)-5-keto-3-methyl-2-pyrazolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=C2C(=NN(C2=O)C3=NC(=C(S3)C(=O)OCC)C)C

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/2\C(=NN(C2=O)C3=NC(=C(S3)C(=O)OCC)C)C

InChI

InChI=1S/C20H21N3O4S/c1-5-26-16-10-8-7-9-14(16)11-15-12(3)22-23(18(15)24)20-21-13(4)17(28-20)19(25)27-6-2/h7-11H,5-6H2,1-4H3/b15-11+