2-tert-butyl-4-[3-(3-fluoranylphenoxy)propylamino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 2-tert-butyl-4-[3-(3-fluoranylphenoxy)propylamino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-tert-butyl-4-[3-(3-fluorophenoxy)propylamino]-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-4-[3-(3-fluorophenoxy)propylamino]-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-tert-butyl-4-[3-(3-fluorophenoxy)propylamino]-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-tert-butyl-4-[3-(3-fluorophenoxy)propylamino]-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C22H25FN2O4S MolecularWeight: 432.508303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCCCOC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCCCOC3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN2O4S/c1-22(2,3)25-21(26)19(20(30(25,27)28)16-9-5-4-6-10-16)24-13-8-14-29-18-12-7-11-17(23)15-18/h4-7,9-12,15,24H,8,13-14H2,1-3H3