2-[(4-cyano-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[(4-cyano-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[(4-cyano-1-morpholino-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[4-cyano-1-(4-morpholinyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[(4-cyano-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[(4-cyano-1-morpholino-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]-N-(2-methoxyphenyl)acetamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CSC2=NC(=C3CCCCC3=C2C#N)N4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CSC2=NC(=C3CCCCC3=C2C#N)N4CCOCC4

InChI

InChI=1S/C23H26N4O3S/c1-29-20-9-5-4-8-19(20)25-21(28)15-31-23-18(14-24)16-6-2-3-7-17(16)22(26-23)27-10-12-30-13-11-27/h4-5,8-9H,2-3,6-7,10-13,15H2,1H3,(H,25,28)