ethyl 6-phenoxy-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]quinoline-3-carboxylate hydrochloride

Systemtic Name: ethyl 6-phenoxy-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]quinoline-3-carboxylate hydrochloride Openeye Name: ethyl 6-phenoxy-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]quinoline-3-carboxylate hydrochloride CAS Name: 6-phenoxy-4-[4-(2-pyrimidinylsulfamoyl)anilino]-3-quinolinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 6-phenoxy-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]quinoline-3-carboxylate hydrochloride Traditional Name: 6-phenoxy-4-[4-(2-pyrimidylsulfamoyl)anilino]quinoline-3-carboxylic acid ethyl ester hydrochloride Formula: C28H24ClN5O5S MolecularWeight: 578.03866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)OC5=CC=CC=C5.Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)OC5=CC=CC=C5.Cl

InChI

InChI=1S/C28H23N5O5S.ClH/c1-2-37-27(34)24-18-31-25-14-11-21(38-20-7-4-3-5-8-20)17-23(25)26(24)32-19-9-12-22(13-10-19)39(35,36)33-28-29-15-6-16-30-28;/h3-18H,2H2,1H3,(H,31,32)(H,29,30,33);1H