S-[[4-(bromomethyl)phenyl]methyl] ethanethioate

Systemtic Name: S-[[4-(bromomethyl)phenyl]methyl] ethanethioate Openeye Name: S-[[4-(bromomethyl)phenyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[4-(bromomethyl)phenyl]methyl] ester IUPAC Name: S-[[4-(bromomethyl)phenyl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[4-(bromomethyl)benzyl] ester Formula: C10H11BrOS MolecularWeight: 259.16274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC=C(C=C1)CBr

Isomeric SMILES

CC(=O)SCC1=CC=C(C=C1)CBr

InChI

InChI=1S/C10H11BrOS/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-5H,6-7H2,1H3