1-(5-bromanyl-2,4-disulfamoyl-phenyl)-3-(4-isocyanophenyl)urea

Systemtic Name: 1-(5-bromanyl-2,4-disulfamoyl-phenyl)-3-(4-isocyanophenyl)urea Openeye Name: 1-(5-bromo-2,4-disulfamoyl-phenyl)-3-(4-isocyanophenyl)urea CAS Name: 1-(5-bromo-2,4-disulfamoylphenyl)-3-(4-isocyanophenyl)urea IUPAC Name: 1-(5-bromo-2,4-disulfamoylphenyl)-3-(4-isocyanophenyl)urea Traditional Name: 1-(5-bromo-2,4-disulfamoyl-phenyl)-3-(4-isocyanophenyl)urea Formula: C14H12BrN5O5S2 MolecularWeight: 474.30958

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Br

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Br

InChI

InChI=1S/C14H12BrN5O5S2/c1-18-8-2-4-9(5-3-8)19-14(21)20-11-6-10(15)12(26(16,22)23)7-13(11)27(17,24)25/h2-7H,(H2,16,22,23)(H2,17,24,25)(H2,19,20,21)