2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-phenethyl-acetamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCCC3=CC=CC=C3)C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H21N3OS/c21-13-17-12-16-8-4-5-9-18(16)23-20(17)25-14-19(24)22-11-10-15-6-2-1-3-7-15/h1-3,6-7,12H,4-5,8-11,14H2,(H,22,24)