(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 2,5-dimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C16H14ClN3O2S MolecularWeight: 347.81926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC3=C(SN=N3)Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC3=C(SN=N3)Cl

InChI

InChI=1S/C16H14ClN3O2S/c1-10-8-13(11(2)20(10)12-6-4-3-5-7-12)16(21)22-9-14-15(17)23-19-18-14/h3-8H,9H2,1-2H3