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

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-[4-[(2-iodanyl-5-methoxy-4-oxidanyl-phenyl)methylsulfamoyl]-2-methoxy-phenyl]thiourea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-[4-[(4-hydroxy-2-iodo-5-methoxy-phenyl)methylsulfamoyl]-2-methoxy-phenyl]thiourea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-[4-[(4-hydroxy-2-iodo-5-methoxyphenyl)methylsulfamoyl]-2-methoxyphenyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-[4-[(4-hydroxy-2-iodo-5-methoxyphenyl)methylsulfamoyl]-2-methoxyphenyl]thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-[4-[(4-hydroxy-2-iodo-5-methoxy-benzyl)sulfamoyl]-2-methoxy-phenyl]thiourea Formula: C27H32IN3O5S2 MolecularWeight: 669.59455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NC2=C(C=C(C=C2)S(=O)(=O)NCC3=CC(=C(C=C3I)O)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NC2=C(C=C(C=C2)S(=O)(=O)NCC3=CC(=C(C=C3I)O)OC)OC

InChI

InChI=1S/C27H32IN3O5S2/c1-27(2,3)19-8-6-17(7-9-19)15-29-26(37)31-22-11-10-20(13-24(22)35-4)38(33,34)30-16-18-12-25(36-5)23(32)14-21(18)28/h6-14,30,32H,15-16H2,1-5H3,(H2,29,31,37)