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

Systemtic Name: 1-[2-(4-fluorophenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[2-(4-fluorophenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[2-(4-fluorophenyl)ethyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[2-(4-fluorophenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-[2-(4-fluorophenyl)ethyl]-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C19H18FN5O2S2 MolecularWeight: 431.506923

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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)NCCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN5O2S2/c20-15-4-2-14(3-5-15)10-13-23-19(28)24-16-6-8-17(9-7-16)29(26,27)25-18-21-11-1-12-22-18/h1-9,11-12H,10,13H2,(H,21,22,25)(H2,23,24,28)