[2-(3-bromanyl-4,5-dimethyl-2-oxidanyl-phenyl)-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-(3-bromanyl-4,5-dimethyl-2-oxidanyl-phenyl)-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-(3-bromo-2-hydroxy-4,5-dimethyl-phenyl)-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-(3-bromo-2-hydroxy-4,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-2-hydroxy-4,5-dimethylphenyl)-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-(3-bromo-2-hydroxy-4,5-dimethyl-phenyl)-2-keto-ethyl] ester Formula: C15H20BrNO2S2 MolecularWeight: 390.3588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)C1=CC(=C(C(=C1O)Br)C)C

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)C1=CC(=C(C(=C1O)Br)C)C

InChI

InChI=1S/C15H20BrNO2S2/c1-5-17(6-2)15(20)21-8-12(18)11-7-9(3)10(4)13(16)14(11)19/h7,19H,5-6,8H2,1-4H3