7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxy-5-methyl-phenyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxy-5-methylphenyl)-2-[(5-methyl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxy-5-methylphenyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-(2-methoxy-5-methyl-phenyl)-2-[(5-methylisoxazol-3-yl)methylthio]quinazolin-4-one Formula: C21H18ClN3O3S MolecularWeight: 427.90392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NOC(=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NOC(=C4)C

InChI

InChI=1S/C21H18ClN3O3S/c1-12-4-7-19(27-3)18(8-12)25-20(26)16-6-5-14(22)10-17(16)23-21(25)29-11-15-9-13(2)28-24-15/h4-10H,11H2,1-3H3