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

Systemtic Name: S-[[2-(4-tert-butylphenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Openeye Name: S-[[2-(4-tert-butylphenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate CAS Name: 2-propenethioic acid S-[[2-(4-tert-butylphenyl)-1,3-dithiolan-4-yl]methyl] ester IUPAC Name: S-[[2-(4-tert-butylphenyl)-1,3-dithiolan-4-yl]methyl] prop-2-enethioate Traditional Name: prop-2-enethioic acid S-[[2-(4-tert-butylphenyl)-1,3-dithiolan-4-yl]methyl] ester Formula: C17H22OS3 MolecularWeight: 338.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2SCC(S2)CSC(=O)C=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2SCC(S2)CSC(=O)C=C

InChI

InChI=1S/C17H22OS3/c1-5-15(18)19-10-14-11-20-16(21-14)12-6-8-13(9-7-12)17(2,3)4/h5-9,14,16H,1,10-11H2,2-4H3