[(2S)-1-(5-bromanyl-4-methyl-2-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [(2S)-1-(5-bromanyl-4-methyl-2-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [(1S)-2-(5-bromo-2-hydroxy-4-methyl-phenyl)-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [(2S)-1-(5-bromo-2-hydroxy-4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(5-bromo-2-hydroxy-4-methylphenyl)-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [(1S)-2-(5-bromo-2-hydroxy-4-methyl-phenyl)-2-keto-1-methyl-ethyl] ester Formula: C15H18BrNO2S2 MolecularWeight: 388.34292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(=O)C(C)SC(=S)N2CCCC2)Br

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(=O)[C@H](C)SC(=S)N2CCCC2)Br

InChI

InChI=1S/C15H18BrNO2S2/c1-9-7-13(18)11(8-12(9)16)14(19)10(2)21-15(20)17-5-3-4-6-17/h7-8,10,18H,3-6H2,1-2H3/t10-/m0/s1