chloranylbenzene; ethyl 5,8-bis(fluoranyl)-4-sulfanylidene-1H-quinoline-3-carboxylate

Systemtic Name: chloranylbenzene; ethyl 5,8-bis(fluoranyl)-4-sulfanylidene-1H-quinoline-3-carboxylate Openeye Name: chlorobenzene; ethyl 5,8-difluoro-4-thioxo-1H-quinoline-3-carboxylate CAS Name: chlorobenzene; 5,8-difluoro-4-sulfanylidene-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: chlorobenzene; ethyl 5,8-difluoro-4-sulfanylidene-1H-quinoline-3-carboxylate Traditional Name: chlorobenzene; 5,8-difluoro-4-thioxo-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H14ClF2NO2S MolecularWeight: 381.824066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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