N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide

C115H118F18N30O25S12 — CID 157322528

IUPACN-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide
SMILESCCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)nnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(=O)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(C)=O)cnc1-c1cn2ccc(C(F)(F)F)cc2n1.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCOCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C
InChIInChI=1S/C20H20F3N5O5S2.C20H22F3N5O4S2.C19H21F3N6O4S2.C19H18F3N5O4S2.C19H20F3N5O4S2.C18H17F3N4O4S2/c1-3-35(31,32)15-8-12(19(29)27-34(30)6-4-33-5-7-34)10-24-16(15)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)2;1-5-33(30,6-2)27-19(29)12-8-15(34(31,32)7-3)16(24-10-12)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)4;1-5-33(30,6-2)27-18(29)11-8-13(34(31,32)7-3)15(23-10-11)17-24-12-9-14(19(20,21)22)25-26-16(12)28(17)4;1-3-33(30,31)14-7-11(18(28)26-32(29)5-4-6-32)9-23-15(14)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)2;1-5-32(4,29)26-18(28)11-7-14(33(30,31)6-2)15(23-9-11)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)3;1-4-31(28,29)14-7-11(17(26)24-30(2,3)27)9-22-16(14)13-10-25-6-5-12(18(19,20)21)8-15(25)23-13/h8-11H,3-7H2,1-2H3;8-11H,5-7H2,1-4H3;8-10H,5-7H2,1-4H3;7-10H,3-6H2,1-2H3;7-10H,5-6H2,1-4H3;5-10H,4H2,1-3H3
InChIKeyBEIKMFOBFOIURW-UHFFFAOYSA-N
MW3047.16 g/mol
LogP17.89
Rot. Bonds29

About N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide

N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide (PubChem CID 157322528) has the molecular formula C115H118F18N30O25S12 and a molecular weight of 3047.16 g/mol. Its IUPAC name is N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide
PubChem CID157322528
Molecular FormulaC115H118F18N30O25S12
Molecular Weight3047.16 g/mol
Exact Mass3044.52
IUPAC NameN-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide
SMILESCCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)nnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(=O)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(C)=O)cnc1-c1cn2ccc(C(F)(F)F)cc2n1.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCOCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C
InChIInChI=1S/C20H20F3N5O5S2.C20H22F3N5O4S2.C19H21F3N6O4S2.C19H18F3N5O4S2.C19H20F3N5O4S2.C18H17F3N4O4S2/c1-3-35(31,32)15-8-12(19(29)27-34(30)6-4-33-5-7-34)10-24-16(15)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)2;1-5-33(30,6-2)27-19(29)12-8-15(34(31,32)7-3)16(24-10-12)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)4;1-5-33(30,6-2)27-18(29)11-8-13(34(31,32)7-3)15(23-10-11)17-24-12-9-14(19(20,21)22)25-26-16(12)28(17)4;1-3-33(30,31)14-7-11(18(28)26-32(29)5-4-6-32)9-23-15(14)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)2;1-5-32(4,29)26-18(28)11-7-14(33(30,31)6-2)15(23-9-11)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)3;1-4-31(28,29)14-7-11(17(26)24-30(2,3)27)9-22-16(14)13-10-25-6-5-12(18(19,20)21)8-15(25)23-13/h8-11H,3-7H2,1-2H3;8-11H,5-7H2,1-4H3;8-10H,5-7H2,1-4H3;7-10H,3-6H2,1-2H3;7-10H,5-6H2,1-4H3;5-10H,4H2,1-3H3
InChIKeyBEIKMFOBFOIURW-UHFFFAOYSA-N
XLogP17.89
TPSA754.15 Ų
H-Bond Donors
H-Bond Acceptors49
Rotatable Bonds29
Heavy Atoms200
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003047.16
LogP ≤ 517.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1049

Analyze N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide?
The IUPAC name of N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide (CID 157322528) is N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide.
What is the SMILES notation for N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide?
The canonical SMILES for N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide is CCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(=O)(CC)CC)cnc1-c1nc2cc(C(F)(F)F)nnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(=O)CC)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S(C)(C)=O)cnc1-c1cn2ccc(C(F)(F)F)cc2n1.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1cc(C(=O)N=S2(=O)CCOCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C.
What is the InChIKey of N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide?
The InChIKey is BEIKMFOBFOIURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F3N5O5S2.C20H22F3N5O4S2.C19H21F3N6O4S2.C19H18F3N5O4S2.C19H20F3N5O4S2.C18H17F3N4O4S2/c1-3-35(31,32)15-8-12(19(29)27-34(30)6-4-33-5-7-34)10-24-16(15)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)2;1-5-33(30,6-2)27-19(29)12-8-15(34(31,32)7-3)16(24-10-12)18-26-14-9-13(20(21,22)23)11-25-17(14)28(18)4;1-5-33(30,6-2)27-18(29)11-8-13(34(31,32)7-3)15(23-10-11)17-24-12-9-14(19(20,21)22)25-26-16(12)28(17)4;1-3-33(30,31)14-7-11(18(28)26-32(29)5-4-6-32)9-23-15(14)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)2;1-5-32(4,29)26-18(28)11-7-14(33(30,31)6-2)15(23-9-11)17-25-13-8-12(19(20,21)22)10-24-16(13)27(17)3;1-4-31(28,29)14-7-11(17(26)24-30(2,3)27)9-22-16(14)13-10-25-6-5-12(18(19,20)21)8-15(25)23-13/h8-11H,3-7H2,1-2H3;8-11H,5-7H2,1-4H3;8-10H,5-7H2,1-4H3;7-10H,3-6H2,1-2H3;7-10H,5-6H2,1-4H3;5-10H,4H2,1-3H3.
What are the key properties of N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide?
N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide has a molecular weight of 3047.16 g/mol, XLogP of 17.89, 29 rotatable bonds, 0 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;N-[diethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-methyl-3-(trifluoromethyl)imidazo[4,5-c]pyridazin-6-yl]pyridine-3-carboxamide;N-[dimethyl(oxo)-λ6-sulfanylidene]-5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]pyridine-3-carboxamide;N-(ethyl-methyl-oxo-λ6-sulfanylidene)-5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(4-oxo-1,4-oxathian-4-ylidene)pyridine-3-carboxamide;5-ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-N-(1-oxothietan-1-ylidene)pyridine-3-carboxamide is sourced from PubChem (CID 157322528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).