1,3-benzothiazol-2-ylmethyl 1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 1-benzylpyrazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-pyrazolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 1-benzylpyrazole-4-carboxylate Traditional Name: 1-benzylpyrazole-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N3O2S/c23-19(24-13-18-21-16-8-4-5-9-17(16)25-18)15-10-20-22(12-15)11-14-6-2-1-3-7-14/h1-10,12H,11,13H2