9-[3-[5-[[2-(1,3-benzothiazol-2-yl)phenyl]carbonylamino]benzimidazol-1-yl]propyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide

Systemtic Name: 9-[3-[5-[[2-(1,3-benzothiazol-2-yl)phenyl]carbonylamino]benzimidazol-1-yl]propyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide Openeye Name: 9-[3-[5-[[2-(1,3-benzothiazol-2-yl)benzoyl]amino]benzimidazol-1-yl]propyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide CAS Name: 9-[3-[5-[[[2-(1,3-benzothiazol-2-yl)phenyl]-oxomethyl]amino]-1-benzimidazolyl]propyl]-N-(2,2,2-trifluoroethyl)-9-fluorenecarboxamide IUPAC Name: 9-[3-[5-[[2-(1,3-benzothiazol-2-yl)benzoyl]amino]benzimidazol-1-yl]propyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide Traditional Name: 9-[3-[5-[[2-(1,3-benzothiazol-2-yl)benzoyl]amino]benzimidazol-1-yl]propyl]-N-(2,2,2-trifluoroethyl)fluorene-9-carboxamide Formula: C40H30F3N5O2S MolecularWeight: 701.75871

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)NC4=CC5=C(C=C4)N(C=N5)CCCC6(C7=CC=CC=C7C8=CC=CC=C86)C(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)NC4=CC5=C(C=C4)N(C=N5)CCCC6(C7=CC=CC=C7C8=CC=CC=C86)C(=O)NCC(F)(F)F

InChI

InChI=1S/C40H30F3N5O2S/c41-40(42,43)23-44-38(50)39(30-14-5-3-10-26(30)27-11-4-6-15-31(27)39)20-9-21-48-24-45-33-22-25(18-19-34(33)48)46-36(49)28-12-1-2-13-29(28)37-47-32-16-7-8-17-35(32)51-37/h1-8,10-19,22,24H,9,20-21,23H2,(H,44,50)(H,46,49)