O-ethyl [1-(4-bromophenyl)-1-oxidanylidene-decan-4-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [1-(4-bromophenyl)-1-oxidanylidene-decan-4-yl]sulfanylmethanethioate Openeye Name: O-ethyl 1-[3-(4-bromophenyl)-3-oxo-propyl]heptylsulfanylmethanethioate CAS Name: [[1-(4-bromophenyl)-1-oxodecan-4-yl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [1-(4-bromophenyl)-1-oxodecan-4-yl]sulfanylmethanethioate Traditional Name: [1-[3-(4-bromophenyl)-3-keto-propyl]heptylthio]methanethioic acid O-ethyl ester Formula: C19H27BrO2S2 MolecularWeight: 431.45048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC(=O)C1=CC=C(C=C1)Br)SC(=S)OCC

Isomeric SMILES

CCCCCCC(CCC(=O)C1=CC=C(C=C1)Br)SC(=S)OCC

InChI

InChI=1S/C19H27BrO2S2/c1-3-5-6-7-8-17(24-19(23)22-4-2)13-14-18(21)15-9-11-16(20)12-10-15/h9-12,17H,3-8,13-14H2,1-2H3