8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane

C107H122F5N33O5S4 — CID 161268865

IUPAC8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane
SMILESCNC(=O)c1c(F)cnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(CC(F)(F)F)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(C(C)=O)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(NC5CC5)nc4)ncn3)ccc(F)c12.S.S.S.S.[2H]c1nc(C)nc([2H])c1-c1cc(NC[C@@H](C)c2cccc3c(C(N)=O)ccnc23)ncn1
InChIInChI=1S/C30H33F4N9O.C30H35N9O2.C25H25FN8O.C22H21N7O.4H2S/c1-18(21-5-4-6-22-26(28(44)35-2)23(31)15-37-27(21)22)12-36-25-11-24(40-17-41-25)19-13-38-29(39-14-19)42(3)20-7-9-43(10-8-20)16-30(32,33)34;1-19(23-6-5-7-24-25(29(41)31-3)8-11-32-28(23)24)15-33-27-14-26(36-18-37-27)21-16-34-30(35-17-21)38(4)22-9-12-39(13-10-22)20(2)40;1-14(17-5-6-19(26)22-18(24(35)27-2)7-8-28-23(17)22)10-29-21-9-20(32-13-33-21)15-11-30-25(31-12-15)34-16-3-4-16;1-13(16-4-3-5-17-18(22(23)30)6-7-24-21(16)17)9-27-20-8-19(28-12-29-20)15-10-25-14(2)26-11-15;;;;/h4-6,11,13-15,17-18,20H,7-10,12,16H2,1-3H3,(H,35,44)(H,36,40,41);5-8,11,14,16-19,22H,9-10,12-13,15H2,1-4H3,(H,31,41)(H,33,36,37);5-9,11-14,16H,3-4,10H2,1-2H3,(H,27,35)(H,29,32,33)(H,30,31,34);3-8,10-13H,9H2,1-2H3,(H2,23,30)(H,27,28,29);4*1H2/t18-;19-;14-;13-;;;;/m1111..../s1/i;;;10D,11D;;;;
InChIKeyVDNWTDVXVHIFQS-HKZYINSDSA-N
MW2175.65 g/mol
LogP15.49
Rot. Bonds31

About 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane

8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane (PubChem CID 161268865) has the molecular formula C107H122F5N33O5S4 and a molecular weight of 2175.65 g/mol. Its IUPAC name is 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane.

Molecular Properties

Compound Name8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane
PubChem CID161268865
Molecular FormulaC107H122F5N33O5S4
Molecular Weight2175.65 g/mol
Exact Mass2173.92
IUPAC Name8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane
SMILESCNC(=O)c1c(F)cnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(CC(F)(F)F)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(C(C)=O)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(NC5CC5)nc4)ncn3)ccc(F)c12.S.S.S.S.[2H]c1nc(C)nc([2H])c1-c1cc(NC[C@@H](C)c2cccc3c(C(N)=O)ccnc23)ncn1
InChIInChI=1S/C30H33F4N9O.C30H35N9O2.C25H25FN8O.C22H21N7O.4H2S/c1-18(21-5-4-6-22-26(28(44)35-2)23(31)15-37-27(21)22)12-36-25-11-24(40-17-41-25)19-13-38-29(39-14-19)42(3)20-7-9-43(10-8-20)16-30(32,33)34;1-19(23-6-5-7-24-25(29(41)31-3)8-11-32-28(23)24)15-33-27-14-26(36-18-37-27)21-16-34-30(35-17-21)38(4)22-9-12-39(13-10-22)20(2)40;1-14(17-5-6-19(26)22-18(24(35)27-2)7-8-28-23(17)22)10-29-21-9-20(32-13-33-21)15-11-30-25(31-12-15)34-16-3-4-16;1-13(16-4-3-5-17-18(22(23)30)6-7-24-21(16)17)9-27-20-8-19(28-12-29-20)15-10-25-14(2)26-11-15;;;;/h4-6,11,13-15,17-18,20H,7-10,12,16H2,1-3H3,(H,35,44)(H,36,40,41);5-8,11,14,16-19,22H,9-10,12-13,15H2,1-4H3,(H,31,41)(H,33,36,37);5-9,11-14,16H,3-4,10H2,1-2H3,(H,27,35)(H,29,32,33)(H,30,31,34);3-8,10-13H,9H2,1-2H3,(H2,23,30)(H,27,28,29);4*1H2/t18-;19-;14-;13-;;;;/m1111..../s1/i;;;10D,11D;;;;
InChIKeyVDNWTDVXVHIFQS-HKZYINSDSA-N
XLogP15.49
TPSA478.37 Ų
H-Bond Donors9
H-Bond Acceptors33
Rotatable Bonds31
Heavy Atoms154
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002175.65
LogP ≤ 515.49
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1033

Analyze 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane with MolForge

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Launch Full Analysis

Related Compounds

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4-[4-[9-(2-aminopyrimidin-5-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]-N-(1-methylpiperidin-4-yl)benzamide
CID 56663021
4-[[2-(Dimethylamino)-1-[3-[(2-piperidin-1-ylpyridine-4-carbonyl)amino]phenyl]ethyl]amino]quinazoline-8-carboxamide
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6-Fluoro-4-[1-[3-[[6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]ethylamino]quinazoline-8-carboxamide
CID 66762989
US8653087, III-417
CID 68036207
US8653087, III-510
CID 68036327
[4-[[5-[4-Methyl-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]-2-pyridinyl]-2-pyridinyl]amino]piperidin-1-yl]-(1,8-naphthyridin-2-yl)methanone
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US10927111, Example 42
CID 155253680
4-cyclopropyl-3-[2-[(1-methylpiperidin-4-yl)amino]quinazolin-7-yl]-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 156038236
Prmt5-IN-25
CID 156830143
2-amino-8-fluoro-N-[[3-(4-pyridin-2-ylpiperazine-1-carbonyl)quinolin-8-yl]methyl]quinazoline-4-carboxamide
CID 127041044

Frequently Asked Questions

What is the IUPAC name of 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane?
The IUPAC name of 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane (CID 161268865) is 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane.
What is the SMILES notation for 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane?
The canonical SMILES for 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane is CNC(=O)c1c(F)cnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(CC(F)(F)F)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(N(C)C5CCN(C(C)=O)CC5)nc4)ncn3)cccc12.CNC(=O)c1ccnc2c([C@H](C)CNc3cc(-c4cnc(NC5CC5)nc4)ncn3)ccc(F)c12.S.S.S.S.[2H]c1nc(C)nc([2H])c1-c1cc(NC[C@@H](C)c2cccc3c(C(N)=O)ccnc23)ncn1.
What is the InChIKey of 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane?
The InChIKey is VDNWTDVXVHIFQS-HKZYINSDSA-N. The full InChI is InChI=1S/C30H33F4N9O.C30H35N9O2.C25H25FN8O.C22H21N7O.4H2S/c1-18(21-5-4-6-22-26(28(44)35-2)23(31)15-37-27(21)22)12-36-25-11-24(40-17-41-25)19-13-38-29(39-14-19)42(3)20-7-9-43(10-8-20)16-30(32,33)34;1-19(23-6-5-7-24-25(29(41)31-3)8-11-32-28(23)24)15-33-27-14-26(36-18-37-27)21-16-34-30(35-17-21)38(4)22-9-12-39(13-10-22)20(2)40;1-14(17-5-6-19(26)22-18(24(35)27-2)7-8-28-23(17)22)10-29-21-9-20(32-13-33-21)15-11-30-25(31-12-15)34-16-3-4-16;1-13(16-4-3-5-17-18(22(23)30)6-7-24-21(16)17)9-27-20-8-19(28-12-29-20)15-10-25-14(2)26-11-15;;;;/h4-6,11,13-15,17-18,20H,7-10,12,16H2,1-3H3,(H,35,44)(H,36,40,41);5-8,11,14,16-19,22H,9-10,12-13,15H2,1-4H3,(H,31,41)(H,33,36,37);5-9,11-14,16H,3-4,10H2,1-2H3,(H,27,35)(H,29,32,33)(H,30,31,34);3-8,10-13H,9H2,1-2H3,(H2,23,30)(H,27,28,29);4*1H2/t18-;19-;14-;13-;;;;/m1111..../s1/i;;;10D,11D;;;;.
What are the key properties of 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane?
8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane has a molecular weight of 2175.65 g/mol, XLogP of 15.49, 31 rotatable bonds, 9 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2S)-1-[[6-[2-[(1-acetylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-[2-(cyclopropylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide;8-[(2S)-1-[[6-(4,6-dideuterio-2-methylpyrimidin-5-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;3-fluoro-N-methyl-8-[(2S)-1-[[6-[2-[methyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane is sourced from PubChem (CID 161268865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).