O-[[(2S)-thiiran-2-yl]methyl] 4-acetamidobenzenecarbothioate

Systemtic Name: O-[[(2S)-thiiran-2-yl]methyl] 4-acetamidobenzenecarbothioate Openeye Name: O-[[(2S)-thiiran-2-yl]methyl] 4-acetamidobenzenecarbothioate CAS Name: 4-acetamidobenzenecarbothioic acid O-[[(2S)-2-thiiranyl]methyl] ester IUPAC Name: O-[[(2S)-thiiran-2-yl]methyl] 4-acetamidobenzenecarbothioate Traditional Name: 4-acetamidothiobenzoic acid O-[[(2S)-thiiran-2-yl]methyl] ester Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=S)OCC2CS2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=S)OC[C@H]2CS2

InChI

InChI=1S/C12H13NO2S2/c1-8(14)13-10-4-2-9(3-5-10)12(16)15-6-11-7-17-11/h2-5,11H,6-7H2,1H3,(H,13,14)/t11-/m0/s1