3-fluoranyl-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-fluoranyl-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-fluoro-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-fluoro-N-[[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-fluoro-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-fluoro-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C19H16FN5O4S2 MolecularWeight: 461.489843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H16FN5O4S2/c1-29-17-10-16(21-11-22-17)25-31(27,28)15-7-5-14(6-8-15)23-19(30)24-18(26)12-3-2-4-13(20)9-12/h2-11H,1H3,(H,21,22,25)(H2,23,24,26,30)