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

Systemtic Name: phenacyl 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate Openeye Name: phenacyl 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 1-phenyl-3-thiophen-2-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(2-thienyl)pyrazole-4-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=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

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