N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate

C122H83Cl2F18N29O9S2 — CID 167568095

About N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate

N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate (PubChem CID 167568095) has the molecular formula C122H83Cl2F18N29O9S2 and a molecular weight of 2576.20 g/mol. Its IUPAC name is N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate.

Molecular Properties

• Compound Name: N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate
• PubChem CID: 167568095
• Molecular Formula: C122H83Cl2F18N29O9S2
• Molecular Weight: 2576.20 g/mol
• Exact Mass: 2573.55
• IUPAC Name: N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate
• SMILES: Cc1ccc(CC(=O)c2ccc(Nc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1ccc(CC(=O)c2ccc(Oc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1cnc(CC(=O)c2ccc(Oc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1cnc(NC(=S)C(=S)Oc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.O=C(Nc1cc(C(F)(F)F)c(Cl)cn1)c1ccc(Cc2cnc3cnccn23)cn1.O=C(Nc1cc(C(F)(F)F)c(Cl)cn1)c1ccc(Oc2cnc3cnccn23)cn1
• InChI: InChI=1S/C22H17F3N4O.C22H16F3N3O2.C21H15F3N4O2.C20H13F3N6OS2.C19H12ClF3N6O.C18H10ClF3N6O2/c1-14-2-3-15(10-18(14)22(23,24)25)11-19(30)16-4-6-17(7-5-16)28-21-13-27-20-12-26-8-9-29(20)21;1-14-2-3-15(10-18(14)22(23,24)25)11-19(29)16-4-6-17(7-5-16)30-21-13-27-20-12-26-8-9-28(20)21;1-13-10-26-15(8-17(13)21(22,23)24)9-18(29)14-2-4-16(5-3-14)30-20-12-27-19-11-25-6-7-28(19)20;1-11-7-25-15(6-13(11)20(21,22)23)28-18(31)19(32)30-17-3-2-12(8-27-17)14-9-26-16-10-24-4-5-29(14)16;20-14-9-26-16(6-13(14)19(21,22)23)28-18(30)15-2-1-11(7-25-15)5-12-8-27-17-10-24-3-4-29(12)17;19-12-7-25-14(5-11(12)18(20,21)22)27-17(29)13-2-1-10(6-24-13)30-16-9-26-15-8-23-3-4-28(15)16/h2-10,12-13,28H,11H2,1H3;2-10,12-13H,11H2,1H3;2-8,10-12H,9H2,1H3;2-10H,1H3,(H,25,28,31);1-4,6-10H,5H2,(H,26,28,30);1-9H,(H,25,27,29)
• InChIKey: FNUZLYJGRGBJPG-UHFFFAOYSA-N
• XLogP: 28.10
• TPSA: 441.76 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 37
• Rotatable Bonds: 26
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2576.20
LogP ≤ 5	28.10
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate?

The IUPAC name of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate (CID 167568095) is N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate.

What is the SMILES notation for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate?

The canonical SMILES for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate is Cc1ccc(CC(=O)c2ccc(Nc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1ccc(CC(=O)c2ccc(Oc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1cnc(CC(=O)c2ccc(Oc3cnc4cnccn34)cc2)cc1C(F)(F)F.Cc1cnc(NC(=S)C(=S)Oc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.O=C(Nc1cc(C(F)(F)F)c(Cl)cn1)c1ccc(Cc2cnc3cnccn23)cn1.O=C(Nc1cc(C(F)(F)F)c(Cl)cn1)c1ccc(Oc2cnc3cnccn23)cn1.

What is the InChIKey of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate?

The InChIKey is FNUZLYJGRGBJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N4O.C22H16F3N3O2.C21H15F3N4O2.C20H13F3N6OS2.C19H12ClF3N6O.C18H10ClF3N6O2/c1-14-2-3-15(10-18(14)22(23,24)25)11-19(30)16-4-6-17(7-5-16)28-21-13-27-20-12-26-8-9-29(20)21;1-14-2-3-15(10-18(14)22(23,24)25)11-19(29)16-4-6-17(7-5-16)30-21-13-27-20-12-26-8-9-28(20)21;1-13-10-26-15(8-17(13)21(22,23)24)9-18(29)14-2-4-16(5-3-14)30-20-12-27-19-11-25-6-7-28(19)20;1-11-7-25-15(6-13(11)20(21,22)23)28-18(31)19(32)30-17-3-2-12(8-27-17)14-9-26-16-10-24-4-5-29(14)16;20-14-9-26-16(6-13(14)19(21,22)23)28-18(30)15-2-1-11(7-25-15)5-12-8-27-17-10-24-3-4-29(12)17;19-12-7-25-14(5-11(12)18(20,21)22)27-17(29)13-2-1-10(6-24-13)30-16-9-26-15-8-23-3-4-28(15)16/h2-10,12-13,28H,11H2,1H3;2-10,12-13H,11H2,1H3;2-8,10-12H,9H2,1H3;2-10H,1H3,(H,25,28,31);1-4,6-10H,5H2,(H,26,28,30);1-9H,(H,25,27,29).

What are the key properties of N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate?

N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate has a molecular weight of 2576.20 g/mol, XLogP of 28.10, 26 rotatable bonds, 4 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-(imidazo[1,2-a]pyrazin-3-ylmethyl)pyridine-2-carboxamide;N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-5-imidazo[1,2-a]pyrazin-3-yloxypyridine-2-carboxamide;1-[4-(imidazo[1,2-a]pyrazin-3-ylamino)phenyl]-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[4-methyl-3-(trifluoromethyl)phenyl]ethanone;1-(4-imidazo[1,2-a]pyrazin-3-yloxyphenyl)-2-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]ethanone;O-(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl) 2-[[5-methyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-sulfanylideneethanethioate is sourced from PubChem (CID 167568095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).