S-(4-tert-butylphenyl) N-prop-2-ynylcarbamothioate

Systemtic Name: S-(4-tert-butylphenyl) N-prop-2-ynylcarbamothioate Openeye Name: S-(4-tert-butylphenyl) N-prop-2-ynylcarbamothioate CAS Name: N-prop-2-ynylcarbamothioic acid S-(4-tert-butylphenyl) ester IUPAC Name: S-(4-tert-butylphenyl) N-prop-2-ynylcarbamothioate Traditional Name: N-propargylthiocarbamic acid S-(4-tert-butylphenyl) ester Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC(=O)NCC#C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC(=O)NCC#C

InChI

InChI=1S/C14H17NOS/c1-5-10-15-13(16)17-12-8-6-11(7-9-12)14(2,3)4/h1,6-9H,10H2,2-4H3,(H,15,16)