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

Systemtic Name: 3-butyl-2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methylthio]quinazolin-4-one Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC(=CC=C4)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC(=CC=C4)C

InChI

InChI=1S/C22H22N4O2S/c1-3-4-12-26-21(27)17-10-5-6-11-18(17)23-22(26)29-14-19-24-25-20(28-19)16-9-7-8-15(2)13-16/h5-11,13H,3-4,12,14H2,1-2H3