diethyl 4-[[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]amino]quinoline-3,6-dicarboxylate

Systemtic Name: diethyl 4-[[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]amino]quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-[4-[(6-chloropyridazin-3-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylate CAS Name: 4-[4-[(6-chloro-3-pyridazinyl)sulfamoyl]anilino]quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[4-[(6-chloropyridazin-3-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylate Traditional Name: 4-[4-[(6-chloropyridazin-3-yl)sulfamoyl]anilino]quinoline-3,6-dicarboxylic acid diethyl ester Formula: C25H22ClN5O6S MolecularWeight: 555.99008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)S(=O)(=O)NC4=NN=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)S(=O)(=O)NC4=NN=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN5O6S/c1-3-36-24(32)15-5-10-20-18(13-15)23(19(14-27-20)25(33)37-4-2)28-16-6-8-17(9-7-16)38(34,35)31-22-12-11-21(26)29-30-22/h5-14H,3-4H2,1-2H3,(H,27,28)(H,30,31)