1-[2-chloranyl-5-(4-oxidanyl-3-prop-2-enyl-2-prop-2-enylimino-1,3-thiazolidin-4-yl)phenyl]sulfonyl-3-cyclohexyl-urea hydrobromide

Systemtic Name: 1-[2-chloranyl-5-(4-oxidanyl-3-prop-2-enyl-2-prop-2-enylimino-1,3-thiazolidin-4-yl)phenyl]sulfonyl-3-cyclohexyl-urea hydrobromide Openeye Name: 1-[5-(3-allyl-2-allylimino-4-hydroxy-thiazolidin-4-yl)-2-chloro-phenyl]sulfonyl-3-cyclohexyl-urea hydrobromide CAS Name: 1-[2-chloro-5-(4-hydroxy-3-prop-2-enyl-2-prop-2-enylimino-4-thiazolidinyl)phenyl]sulfonyl-3-cyclohexylurea hydrobromide IUPAC Name: 1-[2-chloro-5-(4-hydroxy-3-prop-2-enyl-2-prop-2-enylimino-1,3-thiazolidin-4-yl)phenyl]sulfonyl-3-cyclohexylurea hydrobromide Traditional Name: 1-[5-(3-allyl-2-allylimino-4-hydroxy-thiazolidin-4-yl)-2-chloro-phenyl]sulfonyl-3-cyclohexyl-urea hydrobromide Formula: C22H30BrClN4O4S2 MolecularWeight: 593.985

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)NC(=O)NC3CCCCC3)O)CC=C.Br

Isomeric SMILES

C=CCN=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)NC(=O)NC3CCCCC3)O)CC=C.Br

InChI

InChI=1S/C22H29ClN4O4S2.BrH/c1-3-12-24-21-27(13-4-2)22(29,15-32-21)16-10-11-18(23)19(14-16)33(30,31)26-20(28)25-17-8-6-5-7-9-17;/h3-4,10-11,14,17,29H,1-2,5-9,12-13,15H2,(H2,25,26,28);1H