ethyl 2,5-dimethyl-4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H22N4O5S2 MolecularWeight: 450.53178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NC2=NC3=C(S2)C=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NC2=NC3=C(S2)C=C(C=C3)C)C)C

InChI

InChI=1S/C19H22N4O5S2/c1-5-28-18(25)16-11(3)21-12(4)17(16)30(26,27)20-9-15(24)23-19-22-13-7-6-10(2)8-14(13)29-19/h6-8,20-21H,5,9H2,1-4H3,(H,22,23,24)