1,3-benzothiazol-2-ylmethyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-3-methyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H14ClN3O2S MolecularWeight: 383.85136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=NC3=CC=CC=C3S2)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=NC3=CC=CC=C3S2)Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H14ClN3O2S/c1-12-17(18(20)23(22-12)13-7-3-2-4-8-13)19(24)25-11-16-21-14-9-5-6-10-15(14)26-16/h2-10H,11H2,1H3