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

Systemtic Name: [1-(5-bromanyl-2-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [2-(5-bromo-2-hydroxy-phenyl)-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-(5-bromo-2-hydroxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(5-bromo-2-hydroxyphenyl)-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-(5-bromo-2-hydroxy-phenyl)-2-keto-1-methyl-ethyl] ester Formula: C14H16BrNO2S2 MolecularWeight: 374.31634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrNO2S2/c1-9(20-14(19)16-6-2-3-7-16)13(18)11-8-10(15)4-5-12(11)17/h4-5,8-9,17H,2-3,6-7H2,1H3