1,3-benzothiazol-2-ylmethyl 2,5-diphenylpyrazole-3-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2,5-diphenylpyrazole-3-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2,5-diphenylpyrazole-3-carboxylate CAS Name: 2,5-diphenyl-3-pyrazolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2,5-diphenylpyrazole-3-carboxylate Traditional Name: 2,5-diphenylpyrazole-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C24H17N3O2S MolecularWeight: 411.47568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)C(=O)OCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)C(=O)OCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C24H17N3O2S/c28-24(29-16-23-25-19-13-7-8-14-22(19)30-23)21-15-20(17-9-3-1-4-10-17)26-27(21)18-11-5-2-6-12-18/h1-15H,16H2