O-[[4-(methylsulfonylamino)phenyl]methyl] N-[(4-tert-butylphenyl)methyl]carbamothioate

Systemtic Name: O-[[4-(methylsulfonylamino)phenyl]methyl] N-[(4-tert-butylphenyl)methyl]carbamothioate Openeye Name: O-[[4-(methanesulfonamido)phenyl]methyl] N-[(4-tert-butylphenyl)methyl]carbamothioate CAS Name: N-[(4-tert-butylphenyl)methyl]carbamothioic acid O-[[4-(methanesulfonamido)phenyl]methyl] ester IUPAC Name: O-[[4-(methanesulfonamido)phenyl]methyl] N-[(4-tert-butylphenyl)methyl]carbamothioate Traditional Name: N-(4-tert-butylbenzyl)thiocarbamic acid O-[4-(methanesulfonamido)benzyl] ester Formula: C20H26N2O3S2 MolecularWeight: 406.56204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)OCC2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)OCC2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S2/c1-20(2,3)17-9-5-15(6-10-17)13-21-19(26)25-14-16-7-11-18(12-8-16)22-27(4,23)24/h5-12,22H,13-14H2,1-4H3,(H,21,26)