4-[3-(4-fluorophenyl)-5-oxidanylidene-2H-1,2-oxazol-4-yl]pyrimidine-2-carbothialdehyde

Systemtic Name: 4-[3-(4-fluorophenyl)-5-oxidanylidene-2H-1,2-oxazol-4-yl]pyrimidine-2-carbothialdehyde Openeye Name: 4-[3-(4-fluorophenyl)-5-oxo-2H-isoxazol-4-yl]pyrimidine-2-carbothialdehyde CAS Name: 4-[3-(4-fluorophenyl)-5-oxo-2H-isoxazol-4-yl]-2-pyrimidinecarbothioaldehyde IUPAC Name: 4-[3-(4-fluorophenyl)-5-oxo-2H-1,2-oxazol-4-yl]pyrimidine-2-carbothialdehyde Traditional Name: 4-[3-(4-fluorophenyl)-5-keto-3-isoxazolin-4-yl]pyrimidine-2-carbothialdehyde Formula: C14H8FN3O2S MolecularWeight: 301.295623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)ON2)C3=NC(=NC=C3)C=S)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)ON2)C3=NC(=NC=C3)C=S)F

InChI

InChI=1S/C14H8FN3O2S/c15-9-3-1-8(2-4-9)13-12(14(19)20-18-13)10-5-6-16-11(7-21)17-10/h1-7,18H