S-(3-ethoxyphenyl) N-(2-methylbut-3-yn-2-yl)carbamothioate

Systemtic Name: S-(3-ethoxyphenyl) N-(2-methylbut-3-yn-2-yl)carbamothioate Openeye Name: S-(3-ethoxyphenyl) N-(1,1-dimethylprop-2-ynyl)carbamothioate CAS Name: N-(2-methylbut-3-yn-2-yl)carbamothioic acid S-(3-ethoxyphenyl) ester IUPAC Name: S-(3-ethoxyphenyl) N-(2-methylbut-3-yn-2-yl)carbamothioate Traditional Name: N-(1,1-dimethylprop-2-ynyl)thiocarbamic acid S-m-phenetyl ester Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2S/c1-5-14(3,4)15-13(16)18-12-9-7-8-11(10-12)17-6-2/h1,7-10H,6H2,2-4H3,(H,15,16)