2-oxidanylidenepropyl 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate

Systemtic Name: 2-oxidanylidenepropyl 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate Openeye Name: acetonyl 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 1-phenyl-3-thiophen-2-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylic acid acetonyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)COC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O3S/c1-12(20)11-22-17(21)14-10-19(13-6-3-2-4-7-13)18-16(14)15-8-5-9-23-15/h2-10H,11H2,1H3