1-[5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-oxidanyl-phenyl]urea hydrobromide

Systemtic Name: 1-[5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-oxidanyl-phenyl]urea hydrobromide Openeye Name: [5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-hydroxy-phenyl]urea hydrobromide CAS Name: [5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-hydroxyphenyl]urea hydrobromide IUPAC Name: [5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-hydroxyphenyl]urea hydrobromide Traditional Name: [5-[2-[2-(4-butylphenyl)ethylamino]pentyl]-2-hydroxy-phenyl]urea hydrobromide Formula: C24H36BrN3O2 MolecularWeight: 478.46554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCNC(CCC)CC2=CC(=C(C=C2)O)NC(=O)N.Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCNC(CCC)CC2=CC(=C(C=C2)O)NC(=O)N.Br

InChI

InChI=1S/C24H35N3O2.BrH/c1-3-5-7-18-8-10-19(11-9-18)14-15-26-21(6-4-2)16-20-12-13-23(28)22(17-20)27-24(25)29;/h8-13,17,21,26,28H,3-7,14-16H2,1-2H3,(H3,25,27,29);1H