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

Systemtic Name: 6-bromanyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one Openeye Name: 6-bromo-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one CAS Name: 6-bromo-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-(1-phenylethyl)-4-quinazolinone IUPAC Name: 6-bromo-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one Traditional Name: 6-bromo-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-(1-phenylethyl)quinazolin-4-one Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C(C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C(C)C4=CC=CC=C4

InChI

InChI=1S/C22H20BrN3O2S/c1-13-19(15(3)28-25-13)12-29-22-24-20-10-9-17(23)11-18(20)21(27)26(22)14(2)16-7-5-4-6-8-16/h4-11,14H,12H2,1-3H3