N-[3-[(2-chloranyl-5-fluoranyl-phenyl)methyl]-4,5-dimethyl-1,3-thiazol-2-ylidene]adamantane-1-carboxamide

Systemtic Name: N-[3-[(2-chloranyl-5-fluoranyl-phenyl)methyl]-4,5-dimethyl-1,3-thiazol-2-ylidene]adamantane-1-carboxamide Openeye Name: N-[3-[(2-chloro-5-fluoro-phenyl)methyl]-4,5-dimethyl-thiazol-2-ylidene]adamantane-1-carboxamide CAS Name: N-[3-[(2-chloro-5-fluorophenyl)methyl]-4,5-dimethyl-2-thiazolylidene]-1-adamantanecarboxamide IUPAC Name: N-[3-[(2-chloro-5-fluorophenyl)methyl]-4,5-dimethyl-1,3-thiazol-2-ylidene]adamantane-1-carboxamide Traditional Name: N-[3-(2-chloro-5-fluoro-benzyl)-4,5-dimethyl-4-thiazolin-2-ylidene]adamantane-1-carboxamide Formula: C23H26ClFN2OS MolecularWeight: 432.981743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=NC(=O)C23CC4CC(C2)CC(C4)C3)N1CC5=C(C=CC(=C5)F)Cl)C

Isomeric SMILES

CC1=C(SC(=NC(=O)C23CC4CC(C2)CC(C4)C3)N1CC5=C(C=CC(=C5)F)Cl)C

InChI

InChI=1S/C23H26ClFN2OS/c1-13-14(2)29-22(27(13)12-18-8-19(25)3-4-20(18)24)26-21(28)23-9-15-5-16(10-23)7-17(6-15)11-23/h3-4,8,15-17H,5-7,9-12H2,1-2H3