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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=C(C=C3)F

InChI

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