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

Systemtic Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[3-(4-chlorophenyl)-5-isoxazolyl]methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylthio]quinazolin-4-one Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=NO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=NO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O2S/c1-2-11-25-20(26)17-5-3-4-6-18(17)23-21(25)28-13-16-12-19(24-27-16)14-7-9-15(22)10-8-14/h2-10,12H,1,11,13H2