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

Systemtic Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-yl) N-butylcarbamothioate Openeye Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-yl) N-butylcarbamothioate CAS Name: N-butylcarbamothioic acid S-(7-oxabicyclo[2.2.1]hept-2-en-5-yl) ester IUPAC Name: S-(7-oxabicyclo[2.2.1]hept-2-en-5-yl) N-butylcarbamothioate Traditional Name: N-butylthiocarbamic acid S-(7-oxabicyclo[2.2.1]hept-2-en-5-yl) ester Formula: C11H17NO2S MolecularWeight: 227.32318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)SC1CC2C=CC1O2

Isomeric SMILES

CCCCNC(=O)SC1CC2C=CC1O2

InChI

InChI=1S/C11H17NO2S/c1-2-3-6-12-11(13)15-10-7-8-4-5-9(10)14-8/h4-5,8-10H,2-3,6-7H2,1H3,(H,12,13)