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

Systemtic Name: ethyl 6-chloranyl-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]quinoline-3-carboxylate CAS Name: 6-chloro-4-[4-(2-pyrimidinylsulfamoyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]quinoline-3-carboxylate Traditional Name: 6-chloro-4-[4-(2-pyrimidylsulfamoyl)anilino]quinoline-3-carboxylic acid ethyl ester Formula: C22H18ClN5O4S MolecularWeight: 483.92742

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN5O4S/c1-2-32-21(29)18-13-26-19-9-4-14(23)12-17(19)20(18)27-15-5-7-16(8-6-15)33(30,31)28-22-24-10-3-11-25-22/h3-13H,2H2,1H3,(H,26,27)(H,24,25,28)