6-chloranyl-3-[3-(3-methoxypiperidin-2-yl)-2-oxidanylidene-propyl]-7-methylsulfanyl-quinazolin-4-one dihydrobromide

Systemtic Name: 6-chloranyl-3-[3-(3-methoxypiperidin-2-yl)-2-oxidanylidene-propyl]-7-methylsulfanyl-quinazolin-4-one dihydrobromide Openeye Name: 6-chloro-3-[3-(3-methoxy-2-piperidyl)-2-oxo-propyl]-7-methylsulfanyl-quinazolin-4-one dihydrobromide CAS Name: 6-chloro-3-[3-(3-methoxy-2-piperidinyl)-2-oxopropyl]-7-(methylthio)-4-quinazolinone dihydrobromide IUPAC Name: 6-chloro-3-[3-(3-methoxypiperidin-2-yl)-2-oxopropyl]-7-methylsulfanylquinazolin-4-one dihydrobromide Traditional Name: 6-chloro-3-[2-keto-3-(3-methoxy-2-piperidyl)propyl]-7-(methylthio)quinazolin-4-one dihydrobromide Formula: C18H24Br2ClN3O3S MolecularWeight: 557.72746

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCNC1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)SC.Br.Br

Isomeric SMILES

COC1CCCNC1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)SC.Br.Br

InChI

InChI=1S/C18H22ClN3O3S.2BrH/c1-25-16-4-3-5-20-15(16)6-11(23)9-22-10-21-14-8-17(26-2)13(19)7-12(14)18(22)24;;/h7-8,10,15-16,20H,3-6,9H2,1-2H3;2*1H