1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide

C136H178F12N32O8S7 — CID 157331942

About 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide

1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide (PubChem CID 157331942) has the molecular formula C136H178F12N32O8S7 and a molecular weight of 2841.58 g/mol. Its IUPAC name is 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide.

Molecular Properties

• Compound Name: 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide
• PubChem CID: 157331942
• Molecular Formula: C136H178F12N32O8S7
• Molecular Weight: 2841.58 g/mol
• Exact Mass: 2839.24
• IUPAC Name: 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide
• SMILES: CCc1nc(NC2CCN(Cc3ccc4c(cc(C#N)n4C[C@H](C)N4CCC(S(=O)(=O)NC)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1.CCc1nc(NC2CCN(Cc3ccc4c(cc(C)n4C[C@H](C)N4CCN(CC(N)=O)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1.CNS(=O)(=O)C1CCN([C@@H](C)Cn2c(C#N)cc3c(C)c(CN4CCC(Nc5nc(N)nc6sc(CC(F)(F)F)cc56)CC4)ccc32)CC1.COc1nc(NC2CCN(Cc3ccc4c(cc(C)n4C[C@H](C)N4CCN(S(C)(=O)=O)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1
• InChI: InChI=1S/C35H45F3N8O2S2.C35H47F3N8OS.C33H42F3N9O2S2.C33H44F3N7O3S2/c1-5-32-42-33(30-17-27(18-35(36,37)38)49-34(30)43-32)41-25-8-12-44(13-9-25)21-24-6-7-31-29(23(24)3)16-26(19-39)46(31)20-22(2)45-14-10-28(11-15-45)50(47,48)40-4;1-5-32-41-33(29-17-27(18-35(36,37)38)48-34(29)42-32)40-26-8-10-43(11-9-26)20-25-6-7-30-28(24(25)4)16-22(2)46(30)19-23(3)45-14-12-44(13-15-45)21-31(39)47;1-20(44-12-8-26(9-13-44)49(46,47)39-3)18-45-24(17-37)14-27-21(2)22(4-5-29(27)45)19-43-10-6-23(7-11-43)40-30-28-15-25(16-33(34,35)36)48-31(28)42-32(38)41-30;1-21-16-27-23(3)24(6-7-29(27)43(21)19-22(2)41-12-14-42(15-13-41)48(5,44)45)20-40-10-8-25(9-11-40)37-30-28-17-26(18-33(34,35)36)47-31(28)39-32(38-30)46-4/h6-7,16-17,22,25,28,40H,5,8-15,18,20-21H2,1-4H3,(H,41,42,43);6-7,16-17,23,26H,5,8-15,18-21H2,1-4H3,(H2,39,47)(H,40,41,42);4-5,14-15,20,23,26,39H,6-13,16,18-19H2,1-3H3,(H3,38,40,41,42);6-7,16-17,22,25H,8-15,18-20H2,1-5H3,(H,37,38,39)/t22-;23-;20-;22-/m0000/s1
• InChIKey: BFJVWJKYBCYURA-PZMDQZSHSA-N
• XLogP: 21.88
• TPSA: 455.76 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 40
• Rotatable Bonds: 42
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2841.58
LogP ≤ 5	21.88
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide?

The IUPAC name of 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide (CID 157331942) is 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide.

What is the SMILES notation for 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide?

The canonical SMILES for 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide is CCc1nc(NC2CCN(Cc3ccc4c(cc(C#N)n4C[C@H](C)N4CCC(S(=O)(=O)NC)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1.CCc1nc(NC2CCN(Cc3ccc4c(cc(C)n4C[C@H](C)N4CCN(CC(N)=O)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1.CNS(=O)(=O)C1CCN([C@@H](C)Cn2c(C#N)cc3c(C)c(CN4CCC(Nc5nc(N)nc6sc(CC(F)(F)F)cc56)CC4)ccc32)CC1.COc1nc(NC2CCN(Cc3ccc4c(cc(C)n4C[C@H](C)N4CCN(S(C)(=O)=O)CC4)c3C)CC2)c2cc(CC(F)(F)F)sc2n1.

What is the InChIKey of 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide?

The InChIKey is BFJVWJKYBCYURA-PZMDQZSHSA-N. The full InChI is InChI=1S/C35H45F3N8O2S2.C35H47F3N8OS.C33H42F3N9O2S2.C33H44F3N7O3S2/c1-5-32-42-33(30-17-27(18-35(36,37)38)49-34(30)43-32)41-25-8-12-44(13-9-25)21-24-6-7-31-29(23(24)3)16-26(19-39)46(31)20-22(2)45-14-10-28(11-15-45)50(47,48)40-4;1-5-32-41-33(29-17-27(18-35(36,37)38)48-34(29)42-32)40-26-8-10-43(11-9-26)20-25-6-7-30-28(24(25)4)16-22(2)46(30)19-23(3)45-14-12-44(13-15-45)21-31(39)47;1-20(44-12-8-26(9-13-44)49(46,47)39-3)18-45-24(17-37)14-27-21(2)22(4-5-29(27)45)19-43-10-6-23(7-11-43)40-30-28-15-25(16-33(34,35)36)48-31(28)42-32(38)41-30;1-21-16-27-23(3)24(6-7-29(27)43(21)19-22(2)41-12-14-42(15-13-41)48(5,44)45)20-40-10-8-25(9-11-40)37-30-28-17-26(18-33(34,35)36)47-31(28)39-32(38-30)46-4/h6-7,16-17,22,25,28,40H,5,8-15,18,20-21H2,1-4H3,(H,41,42,43);6-7,16-17,23,26H,5,8-15,18-21H2,1-4H3,(H2,39,47)(H,40,41,42);4-5,14-15,20,23,26,39H,6-13,16,18-19H2,1-3H3,(H3,38,40,41,42);6-7,16-17,22,25H,8-15,18-20H2,1-5H3,(H,37,38,39)/t22-;23-;20-;22-/m0000/s1.

What are the key properties of 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide?

1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide has a molecular weight of 2841.58 g/mol, XLogP of 21.88, 42 rotatable bonds, 8 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2S)-1-[5-[[4-[[2-amino-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2-cyano-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;1-[(2S)-1-[2-cyano-5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-4-methylindol-1-yl]propan-2-yl]-N-methylpiperidine-4-sulfonamide;N-[1-[[2,4-dimethyl-1-[(2S)-2-(4-methylsulfonylpiperazin-1-yl)propyl]indol-5-yl]methyl]piperidin-4-yl]-2-methoxy-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;2-[4-[(2S)-1-[5-[[4-[[2-ethyl-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-2,4-dimethylindol-1-yl]propan-2-yl]piperazin-1-yl]acetamide is sourced from PubChem (CID 157331942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).