S-(4-tert-butylphenyl) N-pent-3-yn-2-ylcarbamothioate

Systemtic Name: S-(4-tert-butylphenyl) N-pent-3-yn-2-ylcarbamothioate Openeye Name: S-(4-tert-butylphenyl) N-(1-methylbut-2-ynyl)carbamothioate CAS Name: N-pent-3-yn-2-ylcarbamothioic acid S-(4-tert-butylphenyl) ester IUPAC Name: S-(4-tert-butylphenyl) N-pent-3-yn-2-ylcarbamothioate Traditional Name: N-(1-methylbut-2-ynyl)thiocarbamic acid S-(4-tert-butylphenyl) ester Formula: C16H21NOS MolecularWeight: 275.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)NC(=O)SC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CC#CC(C)NC(=O)SC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C16H21NOS/c1-6-7-12(2)17-15(18)19-14-10-8-13(9-11-14)16(3,4)5/h8-12H,1-5H3,(H,17,18)