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

Systemtic Name: 1,1-dihexyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1,1-dihexyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1,1-dihexyl-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1,1-dihexyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1,1-dihexyl-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C23H35N5O2S2 MolecularWeight: 477.6863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N5O2S2/c1-3-5-7-9-18-28(19-10-8-6-4-2)23(31)26-20-12-14-21(15-13-20)32(29,30)27-22-24-16-11-17-25-22/h11-17H,3-10,18-19H2,1-2H3,(H,26,31)(H,24,25,27)