phenyl 4-chloranyl-3-(4-methylphenyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: phenyl 4-chloranyl-3-(4-methylphenyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: phenyl 4-chloro-1-phenyl-3-(p-tolyl)thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 4-chloro-3-(4-methylphenyl)-1-phenyl-5-thieno[2,3-c]pyrazolecarboxylic acid phenyl ester IUPAC Name: phenyl 4-chloro-3-(4-methylphenyl)-1-phenylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 4-chloro-1-phenyl-3-(p-tolyl)thieno[2,3-c]pyrazole-5-carboxylic acid phenyl ester Formula: C25H17ClN2O2S MolecularWeight: 444.93268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C3=C2C(=C(S3)C(=O)OC4=CC=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C3=C2C(=C(S3)C(=O)OC4=CC=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H17ClN2O2S/c1-16-12-14-17(15-13-16)22-20-21(26)23(25(29)30-19-10-6-3-7-11-19)31-24(20)28(27-22)18-8-4-2-5-9-18/h2-15H,1H3