S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) N-butylcarbamothioate

Systemtic Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) N-butylcarbamothioate Openeye Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) N-butylcarbamothioate CAS Name: N-butylcarbamothioic acid S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) ester IUPAC Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) N-butylcarbamothioate Traditional Name: N-butylthiocarbamic acid S-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethyl) ester Formula: C12H19NO2S MolecularWeight: 241.34976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)SCC1CC2C=CC1O2

Isomeric SMILES

CCCCNC(=O)SCC1CC2C=CC1O2

InChI

InChI=1S/C12H19NO2S/c1-2-3-6-13-12(14)16-8-9-7-10-4-5-11(9)15-10/h4-5,9-11H,2-3,6-8H2,1H3,(H,13,14)