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

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H23N3OS/c1-14-6-7-17-18(11-22)21(26-19(17)10-14)23-20(25)13-24-9-8-15-4-2-3-5-16(15)12-24/h2-5,14H,6-10,12-13H2,1H3,(H,23,25)