S-[3-(2-methylpropyl)phenyl] N-but-3-yn-2-ylcarbamothioate

Systemtic Name: S-[3-(2-methylpropyl)phenyl] N-but-3-yn-2-ylcarbamothioate Openeye Name: S-(3-isobutylphenyl) N-(1-methylprop-2-ynyl)carbamothioate CAS Name: N-but-3-yn-2-ylcarbamothioic acid S-[3-(2-methylpropyl)phenyl] ester IUPAC Name: S-[3-(2-methylpropyl)phenyl] N-but-3-yn-2-ylcarbamothioate Traditional Name: N-(1-methylprop-2-ynyl)thiocarbamic acid S-(3-isobutylphenyl) ester Formula: C15H19NOS MolecularWeight: 261.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=CC=C1)SC(=O)NC(C)C#C

Isomeric SMILES

CC(C)CC1=CC(=CC=C1)SC(=O)NC(C)C#C

InChI

InChI=1S/C15H19NOS/c1-5-12(4)16-15(17)18-14-8-6-7-13(10-14)9-11(2)3/h1,6-8,10-12H,9H2,2-4H3,(H,16,17)