ethyl 1-(2,1,3-benzothiadiazol-4-yl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-(2,1,3-benzothiadiazol-4-yl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-(2,1,3-benzothiadiazol-4-yl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(2,1,3-benzothiadiazol-4-yl)-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,1,3-benzothiadiazol-4-yl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-piazthiol-4-yl-pyrrole-3-carboxylic acid ethyl ester Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=CC3=NSN=C32)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=CC3=NSN=C32)C

InChI

InChI=1S/C15H15N3O2S/c1-4-20-15(19)11-8-9(2)18(10(11)3)13-7-5-6-12-14(13)17-21-16-12/h5-8H,4H2,1-3H3