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

Systemtic Name: 1-(1,2-oxazol-3-yl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-isoxazol-3-yl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(3-isoxazolyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(1,2-oxazol-3-yl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-isoxazol-3-yl-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C14H12N6O3S2 MolecularWeight: 376.41348

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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=NOC=C3

Isomeric SMILES

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

InChI

InChI=1S/C14H12N6O3S2/c21-25(22,20-13-15-7-1-8-16-13)11-4-2-10(3-5-11)17-14(24)18-12-6-9-23-19-12/h1-9H,(H,15,16,20)(H2,17,18,19,24)