1-[4-[(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylsulfamoyl]phenyl]-3-[(4-tert-butylphenyl)methyl]thiourea

Systemtic Name: 1-[4-[(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylsulfamoyl]phenyl]-3-[(4-tert-butylphenyl)methyl]thiourea Openeye Name: 1-[4-[(2-bromo-4-hydroxy-5-methoxy-phenyl)methylsulfamoyl]phenyl]-3-[(4-tert-butylphenyl)methyl]thiourea CAS Name: 1-[4-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylsulfamoyl]phenyl]-3-[(4-tert-butylphenyl)methyl]thiourea IUPAC Name: 1-[4-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylsulfamoyl]phenyl]-3-[(4-tert-butylphenyl)methyl]thiourea Traditional Name: 1-[4-[(2-bromo-4-hydroxy-5-methoxy-benzyl)sulfamoyl]phenyl]-3-(4-tert-butylbenzyl)thiourea Formula: C26H30BrN3O4S2 MolecularWeight: 592.5681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC(=C(C=C3Br)O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC(=C(C=C3Br)O)OC

InChI

InChI=1S/C26H30BrN3O4S2/c1-26(2,3)19-7-5-17(6-8-19)15-28-25(35)30-20-9-11-21(12-10-20)36(32,33)29-16-18-13-24(34-4)23(31)14-22(18)27/h5-14,29,31H,15-16H2,1-4H3,(H2,28,30,35)