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

Systemtic Name: 3-cyanopropyl 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 3-cyanopropyl 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(2-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 1-(2-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid 3-cyanopropyl ester Formula: C17H14ClN3O2S MolecularWeight: 359.82996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCCCC#N)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCCCC#N)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H14ClN3O2S/c1-11-12-10-15(17(22)23-9-5-4-8-19)24-16(12)21(20-11)14-7-3-2-6-13(14)18/h2-3,6-7,10H,4-5,9H2,1H3