3-(3-methoxypropyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methoxypropyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-methoxypropyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methoxypropyl)-2-[[4-(methylthio)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-methoxypropyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-methoxypropyl)-2-[[4-(methylthio)benzyl]thio]quinazolin-4-one Formula: C20H22N2O2S2 MolecularWeight: 386.53088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H22N2O2S2/c1-24-13-5-12-22-19(23)17-6-3-4-7-18(17)21-20(22)26-14-15-8-10-16(25-2)11-9-15/h3-4,6-11H,5,12-14H2,1-2H3