3-(4-butan-2-ylphenyl)-7-chloranyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(4-butan-2-ylphenyl)-7-chloranyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 3-(4-butan-2-ylphenyl)-7-chloro-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(4-butan-2-ylphenyl)-7-chloro-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C24H24ClN3O2S MolecularWeight: 453.98426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=C(ON=C4C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=C(ON=C4C)C

InChI

InChI=1S/C24H24ClN3O2S/c1-5-14(2)17-6-9-19(10-7-17)28-23(29)20-11-8-18(25)12-22(20)26-24(28)31-13-21-15(3)27-30-16(21)4/h6-12,14H,5,13H2,1-4H3