5-azanylidene-6-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-6-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 6-[[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-(2-fluorophenyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 6-[[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-2-(2-fluorophenyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 6-[[1-(3-chloro-4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-(2-fluorophenyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 6-[[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-(2-fluorophenyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C24H16ClF2N5OS MolecularWeight: 495.931546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C=C3C(=N)N4C(=NC3=O)SC(=N4)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C=C3C(=N)N4C(=NC3=O)SC(=N4)C5=CC=CC=C5F

InChI

InChI=1S/C24H16ClF2N5OS/c1-12-9-14(13(2)31(12)15-7-8-20(27)18(25)11-15)10-17-21(28)32-24(29-22(17)33)34-23(30-32)16-5-3-4-6-19(16)26/h3-11,28H,1-2H3