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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-(3,5-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-(3,5-dimethylphenyl)quinazolin-4-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(ON=C4C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(ON=C4C)C)C

InChI

InChI=1S/C22H21N3O2S/c1-13-9-14(2)11-17(10-13)25-21(26)18-7-5-6-8-20(18)23-22(25)28-12-19-15(3)24-27-16(19)4/h5-11H,12H2,1-4H3