3-tert-butyl-1-[2-[(3E)-6-fluoranyl-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethyl]-1-oxidanyl-urea

Systemtic Name: 3-tert-butyl-1-[2-[(3E)-6-fluoranyl-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethyl]-1-oxidanyl-urea Openeye Name: 3-tert-butyl-1-[2-[(3E)-6-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylene]inden-1-yl]ethyl]-1-hydroxy-urea CAS Name: 3-tert-butyl-1-[2-[(3E)-6-fluoro-2-methyl-3-[[4-(methylthio)phenyl]methylidene]-1-indenyl]ethyl]-1-hydroxyurea IUPAC Name: 3-tert-butyl-1-[2-[(3E)-6-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethyl]-1-hydroxyurea Traditional Name: 3-tert-butyl-1-[2-[(3E)-6-fluoro-2-methyl-3-[4-(methylthio)benzylidene]inden-1-yl]ethyl]-1-hydroxy-urea Formula: C25H29FN2O2S MolecularWeight: 440.573363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)SC)C=CC(=C2)F)CCN(C(=O)NC(C)(C)C)O

Isomeric SMILES

CC\1=C(C2=C(/C1=C/C3=CC=C(C=C3)SC)C=CC(=C2)F)CCN(C(=O)NC(C)(C)C)O

InChI

InChI=1S/C25H29FN2O2S/c1-16-20(12-13-28(30)24(29)27-25(2,3)4)23-15-18(26)8-11-21(23)22(16)14-17-6-9-19(31-5)10-7-17/h6-11,14-15,30H,12-13H2,1-5H3,(H,27,29)/b22-14+