N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide

Systemtic Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H25N3OS/c1-2-15-7-8-18-19(12-23)22(27-20(18)11-15)24-21(26)14-25-10-9-16-5-3-4-6-17(16)13-25/h3-6,15H,2,7-11,13-14H2,1H3,(H,24,26)