O2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-keto-2-(piazthiol-4-ylamino)ethyl] ester O4-methyl ester Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C17H16N4O5S/c1-8-13(16(23)25-3)9(2)18-14(8)17(24)26-7-12(22)19-10-5-4-6-11-15(10)21-27-20-11/h4-6,18H,7H2,1-3H3,(H,19,22)