6-ethylsulfanyl-3-[2-oxidanylidene-3-(3-oxidanylpiperidin-2-yl)propyl]quinazolin-4-one dihydrobromide

Systemtic Name: 6-ethylsulfanyl-3-[2-oxidanylidene-3-(3-oxidanylpiperidin-2-yl)propyl]quinazolin-4-one dihydrobromide Openeye Name: 6-ethylsulfanyl-3-[3-(3-hydroxy-2-piperidyl)-2-oxo-propyl]quinazolin-4-one dihydrobromide CAS Name: 6-(ethylthio)-3-[3-(3-hydroxy-2-piperidinyl)-2-oxopropyl]-4-quinazolinone dihydrobromide IUPAC Name: 6-ethylsulfanyl-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one dihydrobromide Traditional Name: 6-(ethylthio)-3-[3-(3-hydroxy-2-piperidyl)-2-keto-propyl]quinazolin-4-one dihydrobromide Formula: C18H25Br2N3O3S MolecularWeight: 523.2824

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC2=C(C=C1)N=CN(C2=O)CC(=O)CC3C(CCCN3)O.Br.Br

Isomeric SMILES

CCSC1=CC2=C(C=C1)N=CN(C2=O)CC(=O)CC3C(CCCN3)O.Br.Br

InChI

InChI=1S/C18H23N3O3S.2BrH/c1-2-25-13-5-6-15-14(9-13)18(24)21(11-20-15)10-12(22)8-16-17(23)4-3-7-19-16;;/h5-6,9,11,16-17,19,23H,2-4,7-8,10H2,1H3;2*1H