2-(1-methylimidazol-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]butyramide Formula: C18H20N6O3S2 MolecularWeight: 432.5198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SC3=NC=CN3C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SC3=NC=CN3C

InChI

InChI=1S/C18H20N6O3S2/c1-3-15(28-18-21-11-12-24(18)2)16(25)22-13-5-7-14(8-6-13)29(26,27)23-17-19-9-4-10-20-17/h4-12,15H,3H2,1-2H3,(H,22,25)(H,19,20,23)