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

Systemtic Name: cyanomethyl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: cyanomethyl 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 cyanomethyl ester IUPAC Name: cyanomethyl 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 cyanomethyl ester Formula: C16H12ClN3O2S MolecularWeight: 345.80338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC#N)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC#N)CC3=CC=CC=C3Cl

InChI

InChI=1S/C16H12ClN3O2S/c1-10-12-8-14(16(21)22-7-6-18)23-15(12)20(19-10)9-11-4-2-3-5-13(11)17/h2-5,8H,7,9H2,1H3