1-propyl-3-[2,4,6-tris(chloranyl)-3,5-disulfamoyl-phenyl]urea

Systemtic Name: 1-propyl-3-[2,4,6-tris(chloranyl)-3,5-disulfamoyl-phenyl]urea Openeye Name: 1-propyl-3-(2,4,6-trichloro-3,5-disulfamoyl-phenyl)urea CAS Name: 1-propyl-3-(2,4,6-trichloro-3,5-disulfamoylphenyl)urea IUPAC Name: 1-propyl-3-(2,4,6-trichloro-3,5-disulfamoylphenyl)urea Traditional Name: 1-propyl-3-(2,4,6-trichloro-3,5-disulfamoyl-phenyl)urea Formula: C10H13Cl3N4O5S2 MolecularWeight: 439.72302

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C(=C(C(=C1Cl)S(=O)(=O)N)Cl)S(=O)(=O)N)Cl

Isomeric SMILES

CCCNC(=O)NC1=C(C(=C(C(=C1Cl)S(=O)(=O)N)Cl)S(=O)(=O)N)Cl

InChI

InChI=1S/C10H13Cl3N4O5S2/c1-2-3-16-10(18)17-7-4(11)8(23(14,19)20)6(13)9(5(7)12)24(15,21)22/h2-3H2,1H3,(H2,14,19,20)(H2,15,21,22)(H2,16,17,18)