ethyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-6-fluoranyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-6-fluoranyl-quinoline-3-carboxylate Openeye Name: ethyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-6-fluoro-quinoline-3-carboxylate CAS Name: 4-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-6-fluoro-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-6-fluoroquinoline-3-carboxylate Traditional Name: 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-6-fluoro-quinoline-3-carboxylic acid ethyl ester Formula: C24H22FN5O4S MolecularWeight: 495.525983

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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)C)C)F

Isomeric SMILES

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

InChI

InChI=1S/C24H22FN5O4S/c1-4-34-23(31)20-13-26-21-10-5-16(25)12-19(21)22(20)29-17-6-8-18(9-7-17)35(32,33)30-24-27-14(2)11-15(3)28-24/h5-13H,4H2,1-3H3,(H,26,29)(H,27,28,30)