methyl N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamate

Systemtic Name: methyl N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamate Openeye Name: methyl N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]carbamate CAS Name: N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamate Traditional Name: N-[(6S)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]carbamic acid methyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)OC

Isomeric SMILES

CC[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)OC

InChI

InChI=1S/C13H16N2O2S/c1-3-8-4-5-9-10(7-14)12(15-13(16)17-2)18-11(9)6-8/h8H,3-6H2,1-2H3,(H,15,16)/t8-/m0/s1