S-(3-methylsulfanylphenyl) N-[2,3-bis(bromanyl)-2-methyl-butyl]carbamothioate

Systemtic Name: S-(3-methylsulfanylphenyl) N-[2,3-bis(bromanyl)-2-methyl-butyl]carbamothioate Openeye Name: S-(3-methylsulfanylphenyl) N-(2,3-dibromo-2-methyl-butyl)carbamothioate CAS Name: N-(2,3-dibromo-2-methylbutyl)carbamothioic acid S-[3-(methylthio)phenyl] ester IUPAC Name: S-(3-methylsulfanylphenyl) N-(2,3-dibromo-2-methylbutyl)carbamothioate Traditional Name: N-(2,3-dibromo-2-methyl-butyl)thiocarbamic acid S-[3-(methylthio)phenyl] ester Formula: C13H17Br2NOS2 MolecularWeight: 427.21818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(CNC(=O)SC1=CC(=CC=C1)SC)Br)Br

Isomeric SMILES

CC(C(C)(CNC(=O)SC1=CC(=CC=C1)SC)Br)Br

InChI

InChI=1S/C13H17Br2NOS2/c1-9(14)13(2,15)8-16-12(17)19-11-6-4-5-10(7-11)18-3/h4-7,9H,8H2,1-3H3,(H,16,17)