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

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)amino]-5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(5-chloro-2-methyl-anilino)-5-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methylene]thiazol-4-one CAS Name: 2-(5-chloro-2-methylanilino)-5-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-4-thiazolone IUPAC Name: 2-(5-chloro-2-methylanilino)-5-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(5-chloro-2-methyl-anilino)-5-(5-fluoro-2-methyl-4-pyrrolidino-benzylidene)-2-thiazolin-4-one Formula: C22H21ClFN3OS MolecularWeight: 429.938043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC2=NC(=O)C(=CC3=CC(=C(C=C3C)N4CCCC4)F)S2

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC2=NC(=O)C(=CC3=CC(=C(C=C3C)N4CCCC4)F)S2

InChI

InChI=1S/C22H21ClFN3OS/c1-13-5-6-16(23)12-18(13)25-22-26-21(28)20(29-22)11-15-10-17(24)19(9-14(15)2)27-7-3-4-8-27/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,25,26,28)