S-[3-[(2S)-butan-2-yl]oxyphenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate

Systemtic Name: S-[3-[(2S)-butan-2-yl]oxyphenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate Openeye Name: S-[3-[(1S)-1-methylpropoxy]phenyl] N-(1,1-dimethylprop-2-ynyl)carbamothioate CAS Name: N-(2-methylbut-3-yn-2-yl)carbamothioic acid S-[3-[(2S)-butan-2-yl]oxyphenyl] ester IUPAC Name: S-[3-[(2S)-butan-2-yl]oxyphenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate Traditional Name: N-(1,1-dimethylprop-2-ynyl)thiocarbamic acid S-[3-[(1S)-1-methylpropoxy]phenyl] ester Formula: C16H21NO2S MolecularWeight: 291.40844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC(=CC=C1)SC(=O)NC(C)(C)C#C

Isomeric SMILES

CC[C@H](C)OC1=CC(=CC=C1)SC(=O)NC(C)(C)C#C

InChI

InChI=1S/C16H21NO2S/c1-6-12(3)19-13-9-8-10-14(11-13)20-15(18)17-16(4,5)7-2/h2,8-12H,6H2,1,3-5H3,(H,17,18)/t12-/m0/s1