2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 2-methylquinoline-4-carboxylate

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 2-methylquinoline-4-carboxylate Openeye Name: 2-(2,5-dichlorophenyl)sulfanylethyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester IUPAC Name: 2-(2,5-dichlorophenyl)sulfanylethyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester Formula: C19H15Cl2NO2S MolecularWeight: 392.2989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCCSC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCCSC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C19H15Cl2NO2S/c1-12-10-15(14-4-2-3-5-17(14)22-12)19(23)24-8-9-25-18-11-13(20)6-7-16(18)21/h2-7,10-11H,8-9H2,1H3