chloranylbenzene; ethyl 6,8-bis(fluoranyl)-4-sulfanylidene-1H-quinoline-3-carboxylate

Systemtic Name: chloranylbenzene; ethyl 6,8-bis(fluoranyl)-4-sulfanylidene-1H-quinoline-3-carboxylate Openeye Name: chlorobenzene; ethyl 6,8-difluoro-4-thioxo-1H-quinoline-3-carboxylate CAS Name: chlorobenzene; 6,8-difluoro-4-sulfanylidene-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: chlorobenzene; ethyl 6,8-difluoro-4-sulfanylidene-1H-quinoline-3-carboxylate Traditional Name: chlorobenzene; 6,8-difluoro-4-thioxo-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H14ClF2NO2S MolecularWeight: 381.824066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=S)F)F.C1=CC=C(C=C1)Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=S)F)F.C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H9F2NO2S.C6H5Cl/c1-2-17-12(16)8-5-15-10-7(11(8)18)3-6(13)4-9(10)14;7-6-4-2-1-3-5-6/h3-5H,2H2,1H3,(H,15,18);1-5H