3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide

Systemtic Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: 3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(4-methoxyphenyl)propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(CCCC3)C=C2C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(CCCC3)C=C2C#N

InChI

InChI=1S/C20H21N3O2S/c1-25-17-8-6-16(7-9-17)22-19(24)10-11-26-20-15(13-21)12-14-4-2-3-5-18(14)23-20/h6-9,12H,2-5,10-11H2,1H3,(H,22,24)