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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[(3,4-dichlorophenyl)methyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(3,4-dichlorobenzyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C18H15Cl2N5O2S2 MolecularWeight: 468.38

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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)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H15Cl2N5O2S2/c19-15-7-2-12(10-16(15)20)11-23-18(28)24-13-3-5-14(6-4-13)29(26,27)25-17-21-8-1-9-22-17/h1-10H,11H2,(H,21,22,25)(H2,23,24,28)