ethyl 2-methyl-4-(3-morpholin-4-ylpropyl)-5-[(E)-(2-oxidanylidene-5-sulfamoyl-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-(3-morpholin-4-ylpropyl)-5-[(E)-(2-oxidanylidene-5-sulfamoyl-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-4-(3-morpholinopropyl)-5-[(E)-(2-oxo-5-sulfamoyl-indolin-3-ylidene)methyl]-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-4-[3-(4-morpholinyl)propyl]-5-[(E)-(2-oxo-5-sulfamoyl-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(3-morpholin-4-ylpropyl)-5-[(E)-(2-oxo-5-sulfamoyl-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-(2-keto-5-sulfamoyl-indolin-3-ylidene)methyl]-2-methyl-4-(3-morpholinopropyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H30N4O6S MolecularWeight: 502.5832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1CCCN2CCOCC2)C=C3C4=C(C=CC(=C4)S(=O)(=O)N)NC3=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1CCCN2CCOCC2)/C=C/3\C4=C(C=CC(=C4)S(=O)(=O)N)NC3=O)C

InChI

InChI=1S/C24H30N4O6S/c1-3-34-24(30)22-15(2)26-21(17(22)5-4-8-28-9-11-33-12-10-28)14-19-18-13-16(35(25,31)32)6-7-20(18)27-23(19)29/h6-7,13-14,26H,3-5,8-12H2,1-2H3,(H,27,29)(H2,25,31,32)/b19-14+