6-bromanyl-2-[(5-chloranylquinolin-8-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[(5-chloranylquinolin-8-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 6-bromo-2-[(5-chloro-8-quinolyl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 6-bromo-2-[(5-chloro-8-quinolinyl)methylthio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 6-bromo-2-[(5-chloroquinolin-8-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 6-bromo-2-[(5-chloro-8-quinolyl)methylthio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C21H17BrClN3O2S MolecularWeight: 490.80058

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C21H17BrClN3O2S/c1-28-10-9-26-20(27)16-11-14(22)5-7-18(16)25-21(26)29-12-13-4-6-17(23)15-3-2-8-24-19(13)15/h2-8,11H,9-10,12H2,1H3