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

Systemtic Name: 1-[(2-fluorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[(2-fluorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[(2-fluorophenyl)methyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[(2-fluorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(2-fluorobenzyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C18H16FN5O2S2 MolecularWeight: 417.480343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)F

InChI

InChI=1S/C18H16FN5O2S2/c19-16-5-2-1-4-13(16)12-22-18(27)23-14-6-8-15(9-7-14)28(25,26)24-17-20-10-3-11-21-17/h1-11H,12H2,(H,20,21,24)(H2,22,23,27)