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

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(2-pyridylsulfamoyl)phenyl]propanamide CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[4-(2-pyridylsulfamoyl)phenyl]propionamide Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C

InChI

InChI=1S/C20H21N5O3S2/c1-14-13-15(2)23-20(22-14)29-12-10-19(26)24-16-6-8-17(9-7-16)30(27,28)25-18-5-3-4-11-21-18/h3-9,11,13H,10,12H2,1-2H3,(H,21,25)(H,24,26)