N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

C136H110F22N32O14S7 — CID 160651151

IUPACN-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
SMILESCCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1cnccn1.CCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1ncccc1F.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(OC(F)(F)F)ccc3n2-c2cnccn2)nc1)C(F)(F)F.Cc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(-c3ncccn3)c2cc1F.Cc1cc2c(cc1F)c(C(N)=O)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1ncccc1F.Cc1cc2c(cc1F)cc(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1nccs1
InChIInChI=1S/C25H23F2N5O2S.C24H23FN6O2S.C23H18F5N5O3S.C22H14F6N6O3S.C22H16F4N6O2S.C20H16F4N4O2S2/c1-5-15-11-22-17(12-20(15)27)18(13-28)23(32(22)24-19(26)7-6-10-29-24)21-9-8-16(14-30-21)35(33,34)31-25(2,3)4;1-5-15-10-21-17(11-19(15)25)18(12-26)23(31(21)22-14-27-8-9-28-22)20-7-6-16(13-29-20)34(32,33)30-24(2,3)4;1-11-8-18-14(9-16(11)25)19(21(29)34)20(33(18)22-15(24)4-3-7-30-22)17-6-5-13(10-31-17)37(35,36)32-12(2)23(26,27)28;1-12(21(23,24)25)33-38(35,36)14-3-4-17(32-10-14)20-16(9-29)15-8-13(37-22(26,27)28)2-5-18(15)34(20)19-11-30-6-7-31-19;1-12-8-15-16(10-27)20(32(19(15)9-17(12)23)21-28-6-3-7-29-21)18-5-4-14(11-30-18)35(33,34)31-13(2)22(24,25)26;1-11-7-17-13(8-15(11)21)9-18(28(17)19-25-5-6-31-19)16-4-3-14(10-26-16)32(29,30)27-12(2)20(22,23)24/h6-12,14,31H,5H2,1-4H3;6-11,13-14,30H,5H2,1-4H3;3-10,12,32H,1-2H3,(H2,29,34);2-8,10-12,33H,1H3;3-9,11,13,31H,1-2H3;3-10,12,27H,1-2H3/t;;2*12-;13-;12-/m..0000/s1
InChIKeyRKKYJYKNDGJNIR-VDHWYQKISA-N
MW3059.01 g/mol
LogP26.35
Rot. Bonds32

About N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (PubChem CID 160651151) has the molecular formula C136H110F22N32O14S7 and a molecular weight of 3059.01 g/mol. Its IUPAC name is N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
PubChem CID160651151
Molecular FormulaC136H110F22N32O14S7
Molecular Weight3059.01 g/mol
Exact Mass3056.66
IUPAC NameN-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
SMILESCCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1cnccn1.CCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1ncccc1F.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(OC(F)(F)F)ccc3n2-c2cnccn2)nc1)C(F)(F)F.Cc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(-c3ncccn3)c2cc1F.Cc1cc2c(cc1F)c(C(N)=O)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1ncccc1F.Cc1cc2c(cc1F)cc(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1nccs1
InChIInChI=1S/C25H23F2N5O2S.C24H23FN6O2S.C23H18F5N5O3S.C22H14F6N6O3S.C22H16F4N6O2S.C20H16F4N4O2S2/c1-5-15-11-22-17(12-20(15)27)18(13-28)23(32(22)24-19(26)7-6-10-29-24)21-9-8-16(14-30-21)35(33,34)31-25(2,3)4;1-5-15-10-21-17(11-19(15)25)18(12-26)23(31(21)22-14-27-8-9-28-22)20-7-6-16(13-29-20)34(32,33)30-24(2,3)4;1-11-8-18-14(9-16(11)25)19(21(29)34)20(33(18)22-15(24)4-3-7-30-22)17-6-5-13(10-31-17)37(35,36)32-12(2)23(26,27)28;1-12(21(23,24)25)33-38(35,36)14-3-4-17(32-10-14)20-16(9-29)15-8-13(37-22(26,27)28)2-5-18(15)34(20)19-11-30-6-7-31-19;1-12-8-15-16(10-27)20(32(19(15)9-17(12)23)21-28-6-3-7-29-21)18-5-4-14(11-30-18)35(33,34)31-13(2)22(24,25)26;1-11-7-17-13(8-15(11)21)9-18(28(17)19-25-5-6-31-19)16-4-3-14(10-26-16)32(29,30)27-12(2)20(22,23)24/h6-12,14,31H,5H2,1-4H3;6-11,13-14,30H,5H2,1-4H3;3-10,12,32H,1-2H3,(H2,29,34);2-8,10-12,33H,1H3;3-9,11,13,31H,1-2H3;3-10,12,27H,1-2H3/t;;2*12-;13-;12-/m..0000/s1
InChIKeyRKKYJYKNDGJNIR-VDHWYQKISA-N
XLogP26.35
TPSA647.43 Ų
H-Bond Donors7
H-Bond Acceptors40
Rotatable Bonds32
Heavy Atoms211
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003059.01
LogP ≤ 526.35
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1040

Analyze N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-cyano-1-cyclopentyl-5-fluoro-6-methylindol-2-yl)-4-methyl-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-(3-fluoro-2-pyridinyl)-5-methylindol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-5-methyl-1-pyrazin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;1-cyclopentyl-5-hydroxy-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;5-methyl-1-pyrimidin-2-yl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide
CID 160703513
6-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethyl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclohexyl-5-fluoro-6-methylindol-2-yl)-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-ethyl-5-fluoro-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;1-cyclobutyl-6-(difluoromethoxy)-5-fluoro-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;1-cyclopentyl-5-fluoro-6-methyl-2-[5-[(1,1,1-trifluoro-2-methylpropan-2-yl)sulfamoyl]-2-pyridinyl]indole-3-carboxamide;1-cyclopentyl-5-fluoro-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide
CID 157263261
6-[1-(3-chloro-2-pyridinyl)-3-cyano-5-fluoro-6-methylindol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
CID 66798271
6-(3-cyano-6-ethyl-5-fluoro-1-pyridin-3-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
CID 66731100
6-ethyl-5-fluoro-1-pyrimidin-2-yl-2-[5-[(1,1,1-trifluoro-2-methylpropan-2-yl)sulfamoyl]-2-pyridinyl]indole-3-carboxamide
CID 66731196
N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyridin-2-ylindol-2-yl)pyridine-3-sulfonamide
CID 66731353
6-[3-cyano-5-fluoro-6-methyl-1-(5-methylpyrimidin-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
CID 66735176
6-ethyl-5-fluoro-2-[4-methyl-5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]-1-pyrimidin-2-ylindole-3-carboxamide
CID 70369836
6-(3-cyano-5-methyl-1-pyrazin-2-ylindol-2-yl)-N-(1,1,1-trifluoropropan-2-yl)pyridine-3-sulfonamide
CID 77181570
6-(3-cyano-6-ethyl-5-fluoro-1-pyridin-4-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
CID 66731311
6-[3-cyano-5-fluoro-6-methyl-1-(1,3-thiazol-4-yl)indol-2-yl]-N-(1,1,1-trifluoropropan-2-yl)pyridine-3-sulfonamide
CID 77181716
6-ethyl-5-fluoro-1-(4-methylphenyl)-2-[5-(1,1,1-trifluoropropan-2-ylsulfamoyl)-2-pyridinyl]indole-3-carboxamide
CID 70369897

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The IUPAC name of N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (CID 160651151) is N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is CCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1cnccn1.CCc1cc2c(cc1F)c(C#N)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cn1)n2-c1ncccc1F.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(OC(F)(F)F)ccc3n2-c2cnccn2)nc1)C(F)(F)F.Cc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(-c3ncccn3)c2cc1F.Cc1cc2c(cc1F)c(C(N)=O)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1ncccc1F.Cc1cc2c(cc1F)cc(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2-c1nccs1.
What is the InChIKey of N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The InChIKey is RKKYJYKNDGJNIR-VDHWYQKISA-N. The full InChI is InChI=1S/C25H23F2N5O2S.C24H23FN6O2S.C23H18F5N5O3S.C22H14F6N6O3S.C22H16F4N6O2S.C20H16F4N4O2S2/c1-5-15-11-22-17(12-20(15)27)18(13-28)23(32(22)24-19(26)7-6-10-29-24)21-9-8-16(14-30-21)35(33,34)31-25(2,3)4;1-5-15-10-21-17(11-19(15)25)18(12-26)23(31(21)22-14-27-8-9-28-22)20-7-6-16(13-29-20)34(32,33)30-24(2,3)4;1-11-8-18-14(9-16(11)25)19(21(29)34)20(33(18)22-15(24)4-3-7-30-22)17-6-5-13(10-31-17)37(35,36)32-12(2)23(26,27)28;1-12(21(23,24)25)33-38(35,36)14-3-4-17(32-10-14)20-16(9-29)15-8-13(37-22(26,27)28)2-5-18(15)34(20)19-11-30-6-7-31-19;1-12-8-15-16(10-27)20(32(19(15)9-17(12)23)21-28-6-3-7-29-21)18-5-4-14(11-30-18)35(33,34)31-13(2)22(24,25)26;1-11-7-17-13(8-15(11)21)9-18(28(17)19-25-5-6-31-19)16-4-3-14(10-26-16)32(29,30)27-12(2)20(22,23)24/h6-12,14,31H,5H2,1-4H3;6-11,13-14,30H,5H2,1-4H3;3-10,12,32H,1-2H3,(H2,29,34);2-8,10-12,33H,1H3;3-9,11,13,31H,1-2H3;3-10,12,27H,1-2H3/t;;2*12-;13-;12-/m..0000/s1.
What are the key properties of N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide has a molecular weight of 3059.01 g/mol, XLogP of 26.35, 32 rotatable bonds, 7 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-[3-cyano-6-ethyl-5-fluoro-1-(3-fluoro-2-pyridinyl)indol-2-yl]pyridine-3-sulfonamide;N-tert-butyl-6-(3-cyano-6-ethyl-5-fluoro-1-pyrazin-2-ylindol-2-yl)pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyrimidin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-pyrazin-2-yl-5-(trifluoromethoxy)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;5-fluoro-1-(3-fluoro-2-pyridinyl)-6-methyl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;6-[5-fluoro-6-methyl-1-(1,3-thiazol-2-yl)indol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 160651151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).