phenacyl 2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxylate

Systemtic Name: phenacyl 2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxylate Openeye Name: phenacyl 2-phenyl-5-(2-thienyl)pyrazole-3-carboxylate CAS Name: 2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-phenyl-5-thiophen-2-ylpyrazole-3-carboxylate Traditional Name: 2-phenyl-5-(2-thienyl)pyrazole-3-carboxylic acid phenacyl ester Formula: C22H16N2O3S MolecularWeight: 388.43904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H16N2O3S/c25-20(16-8-3-1-4-9-16)15-27-22(26)19-14-18(21-12-7-13-28-21)23-24(19)17-10-5-2-6-11-17/h1-14H,15H2