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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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