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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-25-17-7-4-6-16(12-17)22-19(24)9-10-26-20-15(13-21)11-14-5-2-3-8-18(14)23-20/h4,6-7,11-12H,2-3,5,8-10H2,1H3,(H,22,24)