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

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (4-bromo-2-chloro-phenyl) 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxylic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylic acid (4-bromo-2-chloro-phenyl) ester Formula: C19H12BrClN2O2S MolecularWeight: 447.73278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC3=C(C=C(C=C3)Br)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC3=C(C=C(C=C3)Br)Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H12BrClN2O2S/c1-11-14-10-17(19(24)25-16-8-7-12(20)9-15(16)21)26-18(14)23(22-11)13-5-3-2-4-6-13/h2-10H,1H3