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

Systemtic Name: 4-(4-ethylphenyl)-1-[2-(4-methylphenoxy)ethylsulfanyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-(4-ethylphenyl)-1-[2-(4-methylphenoxy)ethylsulfanyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-(4-ethylphenyl)-1-[2-(4-methylphenoxy)ethylthio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-(4-ethylphenyl)-1-[2-(4-methylphenoxy)ethylsulfanyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-(4-ethylphenyl)-1-[2-(4-methylphenoxy)ethylthio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C26H24N4O2S MolecularWeight: 456.55936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCCOC5=CC=C(C=C5)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCCOC5=CC=C(C=C5)C

InChI

InChI=1S/C26H24N4O2S/c1-3-19-10-12-20(13-11-19)29-24(31)22-6-4-5-7-23(22)30-25(29)27-28-26(30)33-17-16-32-21-14-8-18(2)9-15-21/h4-15H,3,16-17H2,1-2H3