(2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-ethanamide

Systemtic Name: (2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-ethanamide Openeye Name: (2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-2-phenylsulfanyl-acetamide CAS Name: (2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-(phenylthio)acetamide IUPAC Name: (2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-phenyl-2-phenylsulfanylacetamide Traditional Name: (2S)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-phenyl-2-(phenylthio)acetamide Formula: C25H24N2OS2 MolecularWeight: 432.60086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)[C@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H24N2OS2/c1-2-17-13-14-20-21(16-26)25(30-22(20)15-17)27-24(28)23(18-9-5-3-6-10-18)29-19-11-7-4-8-12-19/h3-12,17,23H,2,13-15H2,1H3,(H,27,28)/t17-,23+/m1/s1