1-butyl-1-methylsulfonyl-3-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]urea

Systemtic Name: 1-butyl-1-methylsulfonyl-3-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]urea Openeye Name: 1-butyl-1-methylsulfonyl-3-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]urea CAS Name: 1-butyl-1-methylsulfonyl-3-[oxo-[4-(2-pyrimidinylsulfamoyl)anilino]methyl]urea IUPAC Name: 1-butyl-1-methylsulfonyl-3-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]urea Traditional Name: 1-butyl-1-mesyl-3-[[4-(2-pyrimidylsulfamoyl)phenyl]carbamoyl]urea Formula: C17H22N6O6S2 MolecularWeight: 470.52318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)S(=O)(=O)C

Isomeric SMILES

CCCCN(C(=O)NC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)S(=O)(=O)C

InChI

InChI=1S/C17H22N6O6S2/c1-3-4-12-23(30(2,26)27)17(25)21-16(24)20-13-6-8-14(9-7-13)31(28,29)22-15-18-10-5-11-19-15/h5-11H,3-4,12H2,1-2H3,(H,18,19,22)(H2,20,21,24,25)