3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-4-oxazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[[2-(3-chlorophenyl)-5-methyl-oxazol-4-yl]methylthio]quinazolin-4-one Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC(=N3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC(=N3)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C23H22ClN3O2S/c1-3-4-12-27-22(28)18-10-5-6-11-19(18)26-23(27)30-14-20-15(2)29-21(25-20)16-8-7-9-17(24)13-16/h5-11,13H,3-4,12,14H2,1-2H3