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

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]-1-[[4-(methylsulfonylamino)phenyl]methyl]-1-oxidanyl-thiourea Openeye Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)phenyl]methyl]thiourea CAS Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)phenyl]methyl]thiourea IUPAC Name: 3-[(4-tert-butylphenyl)methyl]-1-hydroxy-1-[[4-(methanesulfonamido)phenyl]methyl]thiourea Traditional Name: 3-(4-tert-butylbenzyl)-1-hydroxy-1-[4-(methanesulfonamido)benzyl]thiourea Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O3S2/c1-20(2,3)17-9-5-15(6-10-17)13-21-19(27)23(24)14-16-7-11-18(12-8-16)22-28(4,25)26/h5-12,22,24H,13-14H2,1-4H3,(H,21,27)