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

Systemtic Name: [2-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-(3-bromo-2-hydroxy-5-methyl-phenyl)-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-(3-bromo-2-hydroxy-5-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-2-hydroxy-5-methylphenyl)-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-(3-bromo-2-hydroxy-5-methyl-phenyl)-2-keto-ethyl] ester Formula: C14H18BrNO2S2 MolecularWeight: 376.33222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO2S2/c1-4-16(5-2)14(19)20-8-12(17)10-6-9(3)7-11(15)13(10)18/h6-7,18H,4-5,8H2,1-3H3