3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopropyl-2-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methylthio]quinazolin-4-one Formula: C22H18FN3O2S MolecularWeight: 407.460623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(ON=C1CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H18FN3O2S/c1-13-19(25-28-20(13)14-6-8-15(23)9-7-14)12-29-22-24-18-5-3-2-4-17(18)21(27)26(22)16-10-11-16/h2-9,16H,10-12H2,1H3