S-(4-ethoxyphenyl) N-prop-2-ynylcarbamothioate

Systemtic Name: S-(4-ethoxyphenyl) N-prop-2-ynylcarbamothioate Openeye Name: S-(4-ethoxyphenyl) N-prop-2-ynylcarbamothioate CAS Name: N-prop-2-ynylcarbamothioic acid S-(4-ethoxyphenyl) ester IUPAC Name: S-(4-ethoxyphenyl) N-prop-2-ynylcarbamothioate Traditional Name: N-propargylthiocarbamic acid S-p-phenetyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC(=O)NCC#C

Isomeric SMILES

CCOC1=CC=C(C=C1)SC(=O)NCC#C

InChI

InChI=1S/C12H13NO2S/c1-3-9-13-12(14)16-11-7-5-10(6-8-11)15-4-2/h1,5-8H,4,9H2,2H3,(H,13,14)