6-bromanyl-3-ethyl-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-3-ethyl-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one Openeye Name: 2-acetonylsulfanyl-6-bromo-3-ethyl-quinazolin-4-one CAS Name: 6-bromo-3-ethyl-2-(2-oxopropylthio)-4-quinazolinone IUPAC Name: 6-bromo-3-ethyl-2-(2-oxopropylsulfanyl)quinazolin-4-one Traditional Name: 2-(acetonylthio)-6-bromo-3-ethyl-quinazolin-4-one Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)C

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)C

InChI

InChI=1S/C13H13BrN2O2S/c1-3-16-12(18)10-6-9(14)4-5-11(10)15-13(16)19-7-8(2)17/h4-6H,3,7H2,1-2H3