7-chloranyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 7-chloro-3-propyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-propyl-4-quinazolinone IUPAC Name: 7-chloro-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 7-chloro-3-propyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]quinazolin-4-one Formula: C21H19ClN4O2S MolecularWeight: 426.91916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=NO3)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=NO3)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H19ClN4O2S/c1-3-10-26-20(27)16-9-8-15(22)11-17(16)23-21(26)29-12-18-24-19(25-28-18)14-6-4-13(2)5-7-14/h4-9,11H,3,10,12H2,1-2H3