6,6,7,7-tetramethyl-5-methylsulfanyl-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol

Systemtic Name: 6,6,7,7-tetramethyl-5-methylsulfanyl-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol Openeye Name: 6,6,7,7-tetramethyl-5-methylsulfanyl-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol CAS Name: 6,6,7,7-tetramethyl-5-(methylthio)-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol IUPAC Name: 6,6,7,7-tetramethyl-5-methylsulfanyl-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol Traditional Name: 6,6,7,7-tetramethyl-5-(methylthio)-3-phenyl-4-thia-2-azabicyclo[3.1.1]hept-2-en-1-ol Formula: C16H21NOS2 MolecularWeight: 307.47404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(C(C1(SC(=N2)C3=CC=CC=C3)SC)(C)C)O)C

Isomeric SMILES

CC1(C2(C(C1(SC(=N2)C3=CC=CC=C3)SC)(C)C)O)C

InChI

InChI=1S/C16H21NOS2/c1-13(2)15(18)14(3,4)16(13,19-5)20-12(17-15)11-9-7-6-8-10-11/h6-10,18H,1-5H3