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

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)amino]-5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(3-chloro-2-methyl-anilino)-5-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methylene]thiazol-4-one CAS Name: 2-(3-chloro-2-methylanilino)-5-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-4-thiazolone IUPAC Name: 2-(3-chloro-2-methylanilino)-5-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(3-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=CC(=C(C=C1C=C2C(=O)N=C(S2)NC3=C(C(=CC=C3)Cl)C)F)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1C=C2C(=O)N=C(S2)NC3=C(C(=CC=C3)Cl)C)F)N4CCCC4

InChI

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