S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate

Systemtic Name: S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Openeye Name: S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate CAS Name: 2-propenethioic acid S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] ester IUPAC Name: S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Traditional Name: prop-2-enethioic acid S-[[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl] ester Formula: C13H13BrOS3 MolecularWeight: 361.34072

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)SCC1CSC(S1)C2=CC=C(C=C2)Br

Isomeric SMILES

C=CC(=O)SCC1CSC(S1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrOS3/c1-2-12(15)16-7-11-8-17-13(18-11)9-3-5-10(14)6-4-9/h2-6,11,13H,1,7-8H2