(9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane

C147H158F3IN22O14S3Si2 — CID 158922466

About (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane

(9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane (PubChem CID 158922466) has the molecular formula C147H158F3IN22O14S3Si2 and a molecular weight of 2793.29 g/mol. Its IUPAC name is (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane.

Molecular Properties

• Compound Name: (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane
• PubChem CID: 158922466
• Molecular Formula: C147H158F3IN22O14S3Si2
• Molecular Weight: 2793.29 g/mol
• Exact Mass: 2791.00
• IUPAC Name: (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane
• SMILES: CCN1CC(c2ccc(C(F)(F)F)cc2)N2CC3(CC3)C/C(=C\c3ccc(-n4cnc(C)c4)c4c3CCO4)C2=N1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc(C#N)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc(I)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc([Si](C)(C)C)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(/C=C3\CC4(CC4)CN4C3=NOCC4c3ccc([Si](C)(C)C)cc3)c3c2CC3)cn1
• InChI: InChI=1S/C31H32F3N5O.C31H36N4OSi.C30H36N4O4SSi.C28H27N5O4S.C27H27IN4O4S/c1-3-38-17-27(21-4-7-24(8-5-21)31(32,33)34)39-18-30(11-12-30)15-23(29(39)36-38)14-22-6-9-26(28-25(22)10-13-40-28)37-16-20(2)35-19-37;1-21-17-34(20-32-21)28-12-7-23(26-10-11-27(26)28)15-24-16-31(13-14-31)19-35-29(18-36-33-30(24)35)22-5-8-25(9-6-22)37(2,3)4;1-21-16-33(20-31-21)26-12-7-22(14-27(26)37-3)13-23-15-30(18-39(35,36)19-30)17-34-28(23)32-38-29(34,2)24-8-10-25(11-9-24)40(4,5)6;1-19-14-32(18-30-19)24-9-6-21(11-25(24)36-3)10-22-12-28(16-38(34,35)17-28)15-33-26(22)31-37-27(33,2)23-7-4-20(13-29)5-8-23;1-18-13-31(17-29-18)23-9-4-19(11-24(23)35-3)10-20-12-27(15-37(33,34)16-27)14-32-25(20)30-36-26(32,2)21-5-7-22(28)8-6-21/h4-9,14,16,19,27H,3,10-13,15,17-18H2,1-2H3;5-9,12,15,17,20,29H,10-11,13-14,16,18-19H2,1-4H3;7-14,16,20H,15,17-19H2,1-6H3;4-11,14,18H,12,15-17H2,1-3H3;4-11,13,17H,12,14-16H2,1-3H3/b23-14+;24-15+;23-13+;22-10+;20-10+
• InChIKey: JHZWWCMUBTYRDI-HWTVPLIMSA-N
• XLogP: 24.92
• TPSA: 370.39 Ų
• H-Bond Acceptors: 36
• Rotatable Bonds: 21
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2793.29
LogP ≤ 5	24.92
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane?

The IUPAC name of (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane (CID 158922466) is (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane.

What is the SMILES notation for (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane?

The canonical SMILES for (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane is CCN1CC(c2ccc(C(F)(F)F)cc2)N2CC3(CC3)C/C(=C\c3ccc(-n4cnc(C)c4)c4c3CCO4)C2=N1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc(C#N)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc(I)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.COc1cc(/C=C2\CC3(CN4C2=NOC4(C)c2ccc([Si](C)(C)C)cc2)CS(=O)(=O)C3)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(/C=C3\CC4(CC4)CN4C3=NOCC4c3ccc([Si](C)(C)C)cc3)c3c2CC3)cn1.

What is the InChIKey of (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane?

The InChIKey is JHZWWCMUBTYRDI-HWTVPLIMSA-N. The full InChI is InChI=1S/C31H32F3N5O.C31H36N4OSi.C30H36N4O4SSi.C28H27N5O4S.C27H27IN4O4S/c1-3-38-17-27(21-4-7-24(8-5-21)31(32,33)34)39-18-30(11-12-30)15-23(29(39)36-38)14-22-6-9-26(28-25(22)10-13-40-28)37-16-20(2)35-19-37;1-21-17-34(20-32-21)28-12-7-23(26-10-11-27(26)28)15-24-16-31(13-14-31)19-35-29(18-36-33-30(24)35)22-5-8-25(9-6-22)37(2,3)4;1-21-16-33(20-31-21)26-12-7-22(14-27(26)37-3)13-23-15-30(18-39(35,36)19-30)17-34-28(23)32-38-29(34,2)24-8-10-25(11-9-24)40(4,5)6;1-19-14-32(18-30-19)24-9-6-21(11-25(24)36-3)10-22-12-28(16-38(34,35)17-28)15-33-26(22)31-37-27(33,2)23-7-4-20(13-29)5-8-23;1-18-13-31(17-29-18)23-9-4-19(11-24(23)35-3)10-20-12-27(15-37(33,34)16-27)14-32-25(20)30-36-26(32,2)21-5-7-22(28)8-6-21/h4-9,14,16,19,27H,3,10-13,15,17-18H2,1-2H3;5-9,12,15,17,20,29H,10-11,13-14,16,18-19H2,1-4H3;7-14,16,20H,15,17-19H2,1-6H3;4-11,14,18H,12,15-17H2,1-3H3;4-11,13,17H,12,14-16H2,1-3H3/b23-14+;24-15+;23-13+;22-10+;20-10+.

What are the key properties of (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane?

(9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane has a molecular weight of 2793.29 g/mol, XLogP of 24.92, 21 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for (9E)-2-ethyl-9-[[7-(4-methylimidazol-1-yl)-2,3-dihydro-1-benzofuran-4-yl]methylidene]-4-[4-(trifluoromethyl)phenyl]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]triazine-7,1'-cyclopropane];(8E)-3-(4-iodophenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methylspiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane] 1',1'-dioxide;4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]benzonitrile;[4-[(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-1',1'-dioxospiro[5,7-dihydro-[1,2,4]oxadiazolo[4,3-a]pyridine-6,3'-thietane]-3-yl]phenyl]-trimethylsilane;trimethyl-[4-[(9E)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane]-4-yl]phenyl]silane is sourced from PubChem (CID 158922466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).