O-decyl 2-(5-chloranylquinolin-8-yl)oxyethanethioate

Systemtic Name: O-decyl 2-(5-chloranylquinolin-8-yl)oxyethanethioate Openeye Name: O-decyl 2-[(5-chloro-8-quinolyl)oxy]ethanethioate CAS Name: 2-[(5-chloro-8-quinolinyl)oxy]ethanethioic acid O-decyl ester IUPAC Name: O-decyl 2-(5-chloroquinolin-8-yl)oxyethanethioate Traditional Name: 2-[(5-chloro-8-quinolyl)oxy]ethanethioic acid O-decyl ester Formula: C21H28ClNO2S MolecularWeight: 393.97052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=S)COC1=C2C(=C(C=C1)Cl)C=CC=N2

Isomeric SMILES

CCCCCCCCCCOC(=S)COC1=C2C(=C(C=C1)Cl)C=CC=N2

InChI

InChI=1S/C21H28ClNO2S/c1-2-3-4-5-6-7-8-9-15-24-20(26)16-25-19-13-12-18(22)17-11-10-14-23-21(17)19/h10-14H,2-9,15-16H2,1H3