3-[(4-tert-butylphenyl)methyl]-1-[[3-methoxy-4-(methylsulfonylamino)phenyl]methyl]-1-oxidanyl-thiourea

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]-1-[[3-methoxy-4-(methylsulfonylamino)phenyl]methyl]-1-oxidanyl-thiourea Openeye Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)-3-methoxy-phenyl]methyl]thiourea CAS Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)-3-methoxyphenyl]methyl]thiourea IUPAC Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)-3-methoxyphenyl]methyl]thiourea Traditional Name: 3-(4-tert-butylbenzyl)-1-hydroxy-1-[4-(methanesulfonamido)-3-methoxy-benzyl]thiourea Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)N(CC2=CC(=C(C=C2)NS(=O)(=O)C)OC)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)N(CC2=CC(=C(C=C2)NS(=O)(=O)C)OC)O

InChI

InChI=1S/C21H29N3O4S2/c1-21(2,3)17-9-6-15(7-10-17)13-22-20(29)24(25)14-16-8-11-18(19(12-16)28-4)23-30(5,26)27/h6-12,23,25H,13-14H2,1-5H3,(H,22,29)