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

Systemtic Name: O4-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester O2-ethyl ester IUPAC Name: 4-O-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32)C

InChI

InChI=1S/C18H18N4O5S/c1-4-26-18(25)15-9(2)14(10(3)19-15)17(24)27-8-13(23)20-11-6-5-7-12-16(11)22-28-21-12/h5-7,19H,4,8H2,1-3H3,(H,20,23)