3-(4-tert-butylphenyl)-2-methyl-N-[[4-(methylsulfonylamino)phenyl]methyl]propanethioamide

Systemtic Name: 3-(4-tert-butylphenyl)-2-methyl-N-[[4-(methylsulfonylamino)phenyl]methyl]propanethioamide Openeye Name: 3-(4-tert-butylphenyl)-N-[[4-(methanesulfonamido)phenyl]methyl]-2-methyl-propanethioamide CAS Name: 3-(4-tert-butylphenyl)-N-[[4-(methanesulfonamido)phenyl]methyl]-2-methylpropanethioamide IUPAC Name: 3-(4-tert-butylphenyl)-N-[[4-(methanesulfonamido)phenyl]methyl]-2-methylpropanethioamide Traditional Name: 3-(4-tert-butylphenyl)-N-[4-(methanesulfonamido)benzyl]-2-methyl-thiopropionamide Formula: C22H30N2O2S2 MolecularWeight: 418.6158

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(C)(C)C)C(=S)NCC2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(C)(C)C)C(=S)NCC2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C22H30N2O2S2/c1-16(14-17-6-10-19(11-7-17)22(2,3)4)21(27)23-15-18-8-12-20(13-9-18)24-28(5,25)26/h6-13,16,24H,14-15H2,1-5H3,(H,23,27)