1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-[4-(2-pyrimidinylsulfamoyl)phenyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-[4-(2-pyrimidylsulfamoyl)phenyl]-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C19H27N5O2S2 MolecularWeight: 421.57998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N5O2S2/c1-18(2,3)13-19(4,5)23-17(27)22-14-7-9-15(10-8-14)28(25,26)24-16-20-11-6-12-21-16/h6-12H,13H2,1-5H3,(H,20,21,24)(H2,22,23,27)