S-(3-butoxyphenyl) N-but-3-yn-2-ylcarbamothioate

Systemtic Name: S-(3-butoxyphenyl) N-but-3-yn-2-ylcarbamothioate Openeye Name: S-(3-butoxyphenyl) N-(1-methylprop-2-ynyl)carbamothioate CAS Name: N-but-3-yn-2-ylcarbamothioic acid S-(3-butoxyphenyl) ester IUPAC Name: S-(3-butoxyphenyl) N-but-3-yn-2-ylcarbamothioate Traditional Name: N-(1-methylprop-2-ynyl)thiocarbamic acid S-(3-butoxyphenyl) ester Formula: C15H19NO2S MolecularWeight: 277.38186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC=C1)SC(=O)NC(C)C#C

Isomeric SMILES

CCCCOC1=CC(=CC=C1)SC(=O)NC(C)C#C

InChI

InChI=1S/C15H19NO2S/c1-4-6-10-18-13-8-7-9-14(11-13)19-15(17)16-12(3)5-2/h2,7-9,11-12H,4,6,10H2,1,3H3,(H,16,17)