(6-chloranylpyridin-3-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C14H12ClN3O2S MolecularWeight: 321.78198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CN=C(C=C3)Cl)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CN=C(C=C3)Cl)C

InChI

InChI=1S/C14H12ClN3O2S/c1-8-10-5-11(21-13(10)18(2)17-8)14(19)20-7-9-3-4-12(15)16-6-9/h3-6H,7H2,1-2H3