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

Systemtic Name: S-(3-methylsulfanylphenyl) N,N-bis[2,3-bis(bromanyl)-2-methyl-propyl]carbamothioate Openeye Name: S-(3-methylsulfanylphenyl) N,N-bis(2,3-dibromo-2-methyl-propyl)carbamothioate CAS Name: N,N-bis(2,3-dibromo-2-methylpropyl)carbamothioic acid S-[3-(methylthio)phenyl] ester IUPAC Name: S-(3-methylsulfanylphenyl) N,N-bis(2,3-dibromo-2-methylpropyl)carbamothioate Traditional Name: N,N-bis(2,3-dibromo-2-methyl-propyl)thiocarbamic acid S-[3-(methylthio)phenyl] ester Formula: C16H21Br4NOS2 MolecularWeight: 627.09004

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)(CBr)Br)C(=O)SC1=CC(=CC=C1)SC)(CBr)Br

Isomeric SMILES

CC(CN(CC(C)(CBr)Br)C(=O)SC1=CC(=CC=C1)SC)(CBr)Br

InChI

InChI=1S/C16H21Br4NOS2/c1-15(19,8-17)10-21(11-16(2,20)9-18)14(22)24-13-6-4-5-12(7-13)23-3/h4-7H,8-11H2,1-3H3