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

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(ethenylsulfonylamino)phenyl]methyl]thiourea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(vinylsulfonylamino)phenyl]methyl]thiourea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(ethenylsulfonylamino)phenyl]methyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(ethenylsulfonylamino)phenyl]methyl]thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-[4-(vinylsulfonylamino)benzyl]thiourea Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC=C(C=C2)NS(=O)(=O)C=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC=C(C=C2)NS(=O)(=O)C=C

InChI

InChI=1S/C21H27N3O2S2/c1-5-28(25,26)24-19-12-8-17(9-13-19)15-23-20(27)22-14-16-6-10-18(11-7-16)21(2,3)4/h5-13,24H,1,14-15H2,2-4H3,(H2,22,23,27)