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

Systemtic Name: S-[[2-(phenylmethyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Openeye Name: S-[(2-benzyl-1,3-dithiolan-4-yl)methyl] prop-2-enethioate CAS Name: 2-propenethioic acid S-[[2-(phenylmethyl)-1,3-dithiolan-4-yl]methyl] ester IUPAC Name: S-[(2-benzyl-1,3-dithiolan-4-yl)methyl] prop-2-enethioate Traditional Name: prop-2-enethioic acid S-[(2-benzyl-1,3-dithiolan-4-yl)methyl] ester Formula: C14H16OS3 MolecularWeight: 296.47124

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)SCC1CSC(S1)CC2=CC=CC=C2

Isomeric SMILES

C=CC(=O)SCC1CSC(S1)CC2=CC=CC=C2

InChI

InChI=1S/C14H16OS3/c1-2-13(15)16-9-12-10-17-14(18-12)8-11-6-4-3-5-7-11/h2-7,12,14H,1,8-10H2