cyanomethyl 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: cyanomethyl 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: cyanomethyl 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(4-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(4-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid cyanomethyl ester Formula: C15H10ClN3O2S MolecularWeight: 331.7768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H10ClN3O2S/c1-9-12-8-13(15(20)21-7-6-17)22-14(12)19(18-9)11-4-2-10(16)3-5-11/h2-5,8H,7H2,1H3