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

Systemtic Name: 2-[(4-cyano-1-thiophen-2-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[[4-cyano-1-(2-thienyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[(4-cyano-1-thiophen-2-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[(4-cyano-1-thiophen-2-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[4-cyano-1-(2-thienyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]thio]-N-(2-methoxyphenyl)acetamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CSC2=NC(=C3CCCCC3=C2C#N)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CSC2=NC(=C3CCCCC3=C2C#N)C4=CC=CS4

InChI

InChI=1S/C23H21N3O2S2/c1-28-19-10-5-4-9-18(19)25-21(27)14-30-23-17(13-24)15-7-2-3-8-16(15)22(26-23)20-11-6-12-29-20/h4-6,9-12H,2-3,7-8,14H2,1H3,(H,25,27)