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

Systemtic Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-pyridylthio)acetamide Formula: C17H17N3OS2 MolecularWeight: 343.46638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C17H17N3OS2/c1-11-5-6-12-13(9-18)17(23-14(12)8-11)20-15(21)10-22-16-4-2-3-7-19-16/h2-4,7,11H,5-6,8,10H2,1H3,(H,20,21)/t11-/m0/s1