N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-[(4-fluorophenyl)thio]propionamide Formula: C21H21FN4O3S2 MolecularWeight: 460.544843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3S2/c1-14-13-20(24-15(2)23-14)26-31(28,29)19-9-5-17(6-10-19)25-21(27)11-12-30-18-7-3-16(22)4-8-18/h3-10,13H,11-12H2,1-2H3,(H,25,27)(H,23,24,26)