tert-butyl (E)-5-(2-sulfanylidenepyrrolidin-1-yl)pent-2-enoate

Systemtic Name: tert-butyl (E)-5-(2-sulfanylidenepyrrolidin-1-yl)pent-2-enoate Openeye Name: tert-butyl (E)-5-(2-thioxopyrrolidin-1-yl)pent-2-enoate CAS Name: (E)-5-(2-sulfanylidene-1-pyrrolidinyl)-2-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-5-(2-sulfanylidenepyrrolidin-1-yl)pent-2-enoate Traditional Name: (E)-5-(2-thioxopyrrolidino)pent-2-enoic acid tert-butyl ester Formula: C13H21NO2S MolecularWeight: 255.37634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CCCN1CCCC1=S

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/CCN1CCCC1=S

InChI

InChI=1S/C13H21NO2S/c1-13(2,3)16-12(15)8-4-5-9-14-10-6-7-11(14)17/h4,8H,5-7,9-10H2,1-3H3/b8-4+