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

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C17H13Cl2N5O2S2 MolecularWeight: 454.35342

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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=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H13Cl2N5O2S2/c18-11-2-7-15(14(19)10-11)23-17(27)22-12-3-5-13(6-4-12)28(25,26)24-16-20-8-1-9-21-16/h1-10H,(H,20,21,24)(H2,22,23,27)