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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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