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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N5O2S2/c1-2-3-4-5-6-7-8-9-10-11-17-26-23(31)27-20-13-15-21(16-14-20)32(29,30)28-22-24-18-12-19-25-22/h12-16,18-19H,2-11,17H2,1H3,(H,24,25,28)(H2,26,27,31)