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

Systemtic Name: 7-chloranyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(3-methylphenyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-(m-tolyl)quinazolin-4-one CAS Name: 7-chloro-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-(3-methylphenyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(3-methylphenyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-(m-tolyl)quinazolin-4-one Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=C(ON=C4C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=C(ON=C4C)C

InChI

InChI=1S/C21H18ClN3O2S/c1-12-5-4-6-16(9-12)25-20(26)17-8-7-15(22)10-19(17)23-21(25)28-11-18-13(2)24-27-14(18)3/h4-10H,11H2,1-3H3