2-[(3-chloranyl-2-methyl-phenyl)amino]-5-[(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)amino]-5-[(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(3-chloro-2-methyl-anilino)-5-[(3-fluoro-4-pyrrolidin-1-yl-phenyl)methylene]thiazol-4-one CAS Name: 2-(3-chloro-2-methylanilino)-5-[[3-fluoro-4-(1-pyrrolidinyl)phenyl]methylidene]-4-thiazolone IUPAC Name: 2-(3-chloro-2-methylanilino)-5-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(3-chloro-2-methyl-anilino)-5-(3-fluoro-4-pyrrolidino-benzylidene)-2-thiazolin-4-one Formula: C21H19ClFN3OS MolecularWeight: 415.911463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=NC(=O)C(=CC3=CC(=C(C=C3)N4CCCC4)F)S2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=NC(=O)C(=CC3=CC(=C(C=C3)N4CCCC4)F)S2

InChI

InChI=1S/C21H19ClFN3OS/c1-13-15(22)5-4-6-17(13)24-21-25-20(27)19(28-21)12-14-7-8-18(16(23)11-14)26-9-2-3-10-26/h4-8,11-12H,2-3,9-10H2,1H3,(H,24,25,27)