(2S)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-ethyl-hexanamide

Systemtic Name: (2S)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-ethyl-hexanamide Openeye Name: (2S)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-ethyl-hexanamide CAS Name: (2S)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-ethylhexanamide IUPAC Name: (2S)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-ethylhexanamide Traditional Name: (2S)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-ethyl-hexanamide Formula: C17H24N2OS MolecularWeight: 304.45026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C2=C(S1)CCCC2)C#N

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=C(C2=C(S1)CCCC2)C#N

InChI

InChI=1S/C17H24N2OS/c1-3-5-8-12(4-2)16(20)19-17-14(11-18)13-9-6-7-10-15(13)21-17/h12H,3-10H2,1-2H3,(H,19,20)/t12-/m0/s1