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

Systemtic Name: 1-(4-chlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C17H14ClN5O2S2 MolecularWeight: 419.90836

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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)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2S2/c18-12-2-4-13(5-3-12)21-17(26)22-14-6-8-15(9-7-14)27(24,25)23-16-19-10-1-11-20-16/h1-11H,(H,19,20,23)(H2,21,22,26)