tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium

C170H222F6N14O28S10-2 — CID 161296774

About tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium

tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium (PubChem CID 161296774) has the molecular formula C170H222F6N14O28S10-2 and a molecular weight of 3344.37 g/mol. Its IUPAC name is tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium.

Molecular Properties

• Compound Name: tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium
• PubChem CID: 161296774
• Molecular Formula: C170H222F6N14O28S10-2
• Molecular Weight: 3344.37 g/mol
• Exact Mass: 3341.35
• IUPAC Name: tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium
• SMILES: CCCCC[N+]1=C(C=CC2=C(N(SOO[O-])C(=O)OC(C)(C)C)C(=CC=C3N(CCCCS(=O)([O-])([O-])[N+](CC)(CC)CC)c4ccccc4C3(C)C)CC2)C(C)(C)c2ccccc21.CCCCC[n+]1c(C=CC2=C(N(C)C(=O)OC(C)(C)C)C(=CC=C3Oc4ccccc4N3CCCCSOO[O-])CC2)oc2ccccc21.CCCCC[n+]1c(C=CC2=C(N(C)C(=O)OC(C)(C)C)C(=CC=C3Sc4ccc(C(F)(F)F)cc4N3CCCCSOO[O-])CC2)sc2ccc(C(F)(F)F)cc21.CCCCC[n+]1c(C=CC2=C(N(SOO[O-])C(=O)OC(C)(C)C)C(=CC=C3Sc4ccccc4N3CCCCS(=O)([O-])([O-])[N+](CC)(CC)CC)CC2)sc2ccccc21
• InChI: InChI=1S/C49H72N4O8S2.C43H60N4O8S4.C40H45F6N3O5S3.C38H47N3O7S/c1-12-16-21-34-50-41-26-19-17-24-39(41)48(8,9)43(50)32-30-37-28-29-38(45(37)52(62-61-60-55)46(54)59-47(5,6)7)31-33-44-49(10,11)40-25-18-20-27-42(40)51(44)35-22-23-36-63(56,57,58)53(13-2,14-3)15-4;1-8-12-17-30-44-35-20-13-15-22-37(35)56-39(44)28-26-33-24-25-34(41(33)46(58-55-54-49)42(48)53-43(5,6)7)27-29-40-45(36-21-14-16-23-38(36)57-40)31-18-19-32-59(50,51,52)47(9-2,10-3)11-4;1-6-7-8-21-48-30-24-28(39(41,42)43)15-17-32(30)56-34(48)19-13-26-11-12-27(36(26)47(5)37(50)52-38(2,3)4)14-20-35-49(22-9-10-23-55-54-53-51)31-25-29(40(44,45)46)16-18-33(31)57-35;1-6-7-12-25-40-30-15-8-10-17-32(30)44-34(40)23-21-28-19-20-29(36(28)39(5)37(42)46-38(2,3)4)22-24-35-41(26-13-14-27-49-48-47-43)31-16-9-11-18-33(31)45-35/h17-20,24-27,30-33H,12-16,21-23,28-29,34-36H2,1-11H3,(H-2,55,56,57,58);13-16,20-23,26-29H,8-12,17-19,24-25,30-32H2,1-7H3,(H-2,49,50,51,52);13-20,24-25H,6-12,21-23H2,1-5H3;8-11,15-18,21-24H,6-7,12-14,19-20,25-27H2,1-5H3/p-2
• InChIKey: XESNZLGPPRSQJA-UHFFFAOYSA-L
• XLogP: 39.17
• TPSA: 460.60 Ų
• H-Bond Acceptors: 40
• Rotatable Bonds: 70
• Heavy Atoms: 228
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3344.37
LogP ≤ 5	39.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium?

The IUPAC name of tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium (CID 161296774) is tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium.

What is the SMILES notation for tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium?

The canonical SMILES for tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium is CCCCC[N+]1=C(C=CC2=C(N(SOO[O-])C(=O)OC(C)(C)C)C(=CC=C3N(CCCCS(=O)([O-])([O-])[N+](CC)(CC)CC)c4ccccc4C3(C)C)CC2)C(C)(C)c2ccccc21.CCCCC[n+]1c(C=CC2=C(N(C)C(=O)OC(C)(C)C)C(=CC=C3Oc4ccccc4N3CCCCSOO[O-])CC2)oc2ccccc21.CCCCC[n+]1c(C=CC2=C(N(C)C(=O)OC(C)(C)C)C(=CC=C3Sc4ccc(C(F)(F)F)cc4N3CCCCSOO[O-])CC2)sc2ccc(C(F)(F)F)cc21.CCCCC[n+]1c(C=CC2=C(N(SOO[O-])C(=O)OC(C)(C)C)C(=CC=C3Sc4ccccc4N3CCCCS(=O)([O-])([O-])[N+](CC)(CC)CC)CC2)sc2ccccc21.

What is the InChIKey of tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium?

The InChIKey is XESNZLGPPRSQJA-UHFFFAOYSA-L. The full InChI is InChI=1S/C49H72N4O8S2.C43H60N4O8S4.C40H45F6N3O5S3.C38H47N3O7S/c1-12-16-21-34-50-41-26-19-17-24-39(41)48(8,9)43(50)32-30-37-28-29-38(45(37)52(62-61-60-55)46(54)59-47(5,6)7)31-33-44-49(10,11)40-25-18-20-27-42(40)51(44)35-22-23-36-63(56,57,58)53(13-2,14-3)15-4;1-8-12-17-30-44-35-20-13-15-22-37(35)56-39(44)28-26-33-24-25-34(41(33)46(58-55-54-49)42(48)53-43(5,6)7)27-29-40-45(36-21-14-16-23-38(36)57-40)31-18-19-32-59(50,51,52)47(9-2,10-3)11-4;1-6-7-8-21-48-30-24-28(39(41,42)43)15-17-32(30)56-34(48)19-13-26-11-12-27(36(26)47(5)37(50)52-38(2,3)4)14-20-35-49(22-9-10-23-55-54-53-51)31-25-29(40(44,45)46)16-18-33(31)57-35;1-6-7-12-25-40-30-15-8-10-17-32(30)44-34(40)23-21-28-19-20-29(36(28)39(5)37(42)46-38(2,3)4)22-24-35-41(26-13-14-27-49-48-47-43)31-16-9-11-18-33(31)45-35/h17-20,24-27,30-33H,12-16,21-23,28-29,34-36H2,1-11H3,(H-2,55,56,57,58);13-16,20-23,26-29H,8-12,17-19,24-25,30-32H2,1-7H3,(H-2,49,50,51,52);13-20,24-25H,6-12,21-23H2,1-5H3;8-11,15-18,21-24H,6-7,12-14,19-20,25-27H2,1-5H3/p-2.

What are the key properties of tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium?

tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium has a molecular weight of 3344.37 g/mol, XLogP of 39.17, 70 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-1,3-benzoxazol-2-ylidene]ethylidene]-2-[2-(3-pentyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]cyclopenten-1-yl]carbamate;tert-butyl N-methyl-N-[5-[2-[3-(4-oxidoperoxysulfanylbutyl)-5-(trifluoromethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-2-[2-[3-pentyl-5-(trifluoromethyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl]cyclopenten-1-yl]carbamate;[4-[2-[2-[3-[2-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)ethenyl]-2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butyl-dioxido-oxo-λ6-sulfanyl]-triethylazanium;triethyl-[4-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonyl-oxidoperoxysulfanylamino]-3-[2-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-1,3-benzothiazol-3-yl]butyl-dioxido-oxo-λ6-sulfanyl]azanium is sourced from PubChem (CID 161296774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).