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

Systemtic Name: 1-[(4-bromophenyl)sulfonylamino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[(4-bromophenyl)sulfonylamino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[(4-bromophenyl)sulfonylamino]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[(4-bromophenyl)sulfonylamino]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(brosylamino)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C17H15BrN6O4S3 MolecularWeight: 543.4378

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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)NNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN6O4S3/c18-12-2-6-15(7-3-12)31(27,28)24-22-17(29)21-13-4-8-14(9-5-13)30(25,26)23-16-19-10-1-11-20-16/h1-11,24H,(H,19,20,23)(H2,21,22,29)