phenyl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: phenyl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: phenyl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid phenyl ester IUPAC Name: phenyl 1-[(2-chlorophenyl)methyl]-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(2-chlorobenzyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid phenyl ester Formula: C20H15ClN2O2S MolecularWeight: 382.8633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC=CC=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC=CC=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C20H15ClN2O2S/c1-13-16-11-18(20(24)25-15-8-3-2-4-9-15)26-19(16)23(22-13)12-14-7-5-6-10-17(14)21/h2-11H,12H2,1H3