(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxylic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C20H15ClN4O3S MolecularWeight: 426.8761

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3=C(SN=N3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3=C(SN=N3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H15ClN4O3S/c1-27-15-9-5-6-13(10-15)18-16(11-25(23-18)14-7-3-2-4-8-14)20(26)28-12-17-19(21)29-24-22-17/h2-11H,12H2,1H3