1-(3-bromanyl-4-morpholin-4-yl-phenyl)-2-quinolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-(3-bromanyl-4-morpholin-4-yl-phenyl)-2-quinolin-4-ylsulfanyl-ethanone Openeye Name: 1-(3-bromo-4-morpholino-phenyl)-2-(4-quinolylsulfanyl)ethanone CAS Name: 1-[3-bromo-4-(4-morpholinyl)phenyl]-2-(4-quinolinylthio)ethanone IUPAC Name: 1-(3-bromo-4-morpholin-4-ylphenyl)-2-quinolin-4-ylsulfanylethanone Traditional Name: 1-(3-bromo-4-morpholino-phenyl)-2-(4-quinolylthio)ethanone Formula: C21H19BrN2O2S MolecularWeight: 443.35676

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)CSC3=CC=NC4=CC=CC=C43)Br

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)CSC3=CC=NC4=CC=CC=C43)Br

InChI

InChI=1S/C21H19BrN2O2S/c22-17-13-15(5-6-19(17)24-9-11-26-12-10-24)20(25)14-27-21-7-8-23-18-4-2-1-3-16(18)21/h1-8,13H,9-12,14H2