1-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-[2-(4-bromophenoxy)ethylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[2-(4-bromophenoxy)ethylthio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-[2-(4-bromophenoxy)ethylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-[2-(4-bromophenoxy)ethylthio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C20H19BrN4O2S MolecularWeight: 459.35946

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCOC4=CC=C(C=C4)Br

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCOC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrN4O2S/c1-2-11-24-18(26)16-5-3-4-6-17(16)25-19(24)22-23-20(25)28-13-12-27-15-9-7-14(21)8-10-15/h3-10H,2,11-13H2,1H3