(4-cyanophenyl)methyl 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylbenzoate

Systemtic Name: (4-cyanophenyl)methyl 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylbenzoate Openeye Name: (4-cyanophenyl)methyl 2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylbenzoate CAS Name: 2-[[(3S)-1,1-dioxo-3-thiolanyl]thio]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylbenzoate Traditional Name: 2-[[(3S)-1,1-diketothiolan-3-yl]thio]benzoic acid (4-cyanobenzyl) ester Formula: C19H17NO4S2 MolecularWeight: 387.47258

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1SC2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1SC2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17NO4S2/c20-11-14-5-7-15(8-6-14)12-24-19(21)17-3-1-2-4-18(17)25-16-9-10-26(22,23)13-16/h1-8,16H,9-10,12-13H2/t16-/m0/s1