S-(3-ethylphenyl) N-prop-2-ynylcarbamothioate

Systemtic Name: S-(3-ethylphenyl) N-prop-2-ynylcarbamothioate Openeye Name: S-(3-ethylphenyl) N-prop-2-ynylcarbamothioate CAS Name: N-prop-2-ynylcarbamothioic acid S-(3-ethylphenyl) ester IUPAC Name: S-(3-ethylphenyl) N-prop-2-ynylcarbamothioate Traditional Name: N-propargylthiocarbamic acid S-(3-ethylphenyl) ester Formula: C12H13NOS MolecularWeight: 219.30272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)SC(=O)NCC#C

Isomeric SMILES

CCC1=CC(=CC=C1)SC(=O)NCC#C

InChI

InChI=1S/C12H13NOS/c1-3-8-13-12(14)15-11-7-5-6-10(4-2)9-11/h1,5-7,9H,4,8H2,2H3,(H,13,14)