(4-pyrazol-1-ylphenyl)methyl 5-chloranylthiophene-2-carboxylate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 5-chloranylthiophene-2-carboxylate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 5-chlorothiophene-2-carboxylate CAS Name: 5-chloro-2-thiophenecarboxylic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 5-chlorothiophene-2-carboxylate Traditional Name: 5-chlorothiophene-2-carboxylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H11ClN2O2S/c16-14-7-6-13(21-14)15(19)20-10-11-2-4-12(5-3-11)18-9-1-8-17-18/h1-9H,10H2