6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide

C116H158Cl4N18O7S3 — CID 159479304

About 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide

6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide (PubChem CID 159479304) has the molecular formula C116H158Cl4N18O7S3 and a molecular weight of 2154.67 g/mol. Its IUPAC name is 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide.

Molecular Properties

• Compound Name: 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide
• PubChem CID: 159479304
• Molecular Formula: C116H158Cl4N18O7S3
• Molecular Weight: 2154.67 g/mol
• Exact Mass: 2151.05
• IUPAC Name: 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide
• SMILES: Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=O)N(C3CCCCC3)CC2c2ccsc2)CC1.Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=S)N(C(C)C)CC2c2cccc(Cl)c2)CC1.Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=S)N(CC(C)C)CC2c2ccccc2)CC1.Cc1cccc(C)c1C(=O)NCCC(C)N1CCC(N2C(=O)OC[C@H]2c2ccccc2)CC1
• InChI: InChI=1S/C30H42ClN5O2S.C30H42ClN5OS.C29H39Cl2N5OS.C27H35N3O3/c1-20-17-27(31)33-22(3)28(20)29(37)32-13-9-21(2)34-14-10-25(11-15-34)36-26(23-12-16-39-19-23)18-35(30(36)38)24-7-5-4-6-8-24;1-20(2)18-35-19-26(24-9-7-6-8-10-24)36(30(35)38)25-12-15-34(16-13-25)22(4)11-14-32-29(37)28-21(3)17-27(31)33-23(28)5;1-18(2)35-17-25(22-7-6-8-23(30)16-22)36(29(35)38)24-10-13-34(14-11-24)20(4)9-12-32-28(37)27-19(3)15-26(31)33-21(27)5;1-19-8-7-9-20(2)25(19)26(31)28-15-12-21(3)29-16-13-23(14-17-29)30-24(18-33-27(30)32)22-10-5-4-6-11-22/h12,16-17,19,21,24-26H,4-11,13-15,18H2,1-3H3,(H,32,37);6-10,17,20,22,25-26H,11-16,18-19H2,1-5H3,(H,32,37);6-8,15-16,18,20,24-25H,9-14,17H2,1-5H3,(H,32,37);4-11,21,23-24H,12-18H2,1-3H3,(H,28,31)/t;;;21?,24-/m...0/s1
• InChIKey: LWUJKXITXHKIEA-NLFWDRCPSA-N
• XLogP: 22.32
• TPSA: 234.08 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 17
• Rotatable Bonds: 32
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2154.67
LogP ≤ 5	22.32
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide?

The IUPAC name of 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide (CID 159479304) is 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide.

What is the SMILES notation for 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide?

The canonical SMILES for 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide is Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=O)N(C3CCCCC3)CC2c2ccsc2)CC1.Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=S)N(C(C)C)CC2c2cccc(Cl)c2)CC1.Cc1cc(Cl)nc(C)c1C(=O)NCCC(C)N1CCC(N2C(=S)N(CC(C)C)CC2c2ccccc2)CC1.Cc1cccc(C)c1C(=O)NCCC(C)N1CCC(N2C(=O)OC[C@H]2c2ccccc2)CC1.

What is the InChIKey of 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide?

The InChIKey is LWUJKXITXHKIEA-NLFWDRCPSA-N. The full InChI is InChI=1S/C30H42ClN5O2S.C30H42ClN5OS.C29H39Cl2N5OS.C27H35N3O3/c1-20-17-27(31)33-22(3)28(20)29(37)32-13-9-21(2)34-14-10-25(11-15-34)36-26(23-12-16-39-19-23)18-35(30(36)38)24-7-5-4-6-8-24;1-20(2)18-35-19-26(24-9-7-6-8-10-24)36(30(35)38)25-12-15-34(16-13-25)22(4)11-14-32-29(37)28-21(3)17-27(31)33-23(28)5;1-18(2)35-17-25(22-7-6-8-23(30)16-22)36(29(35)38)24-10-13-34(14-11-24)20(4)9-12-32-28(37)27-19(3)15-26(31)33-21(27)5;1-19-8-7-9-20(2)25(19)26(31)28-15-12-21(3)29-16-13-23(14-17-29)30-24(18-33-27(30)32)22-10-5-4-6-11-22/h12,16-17,19,21,24-26H,4-11,13-15,18H2,1-3H3,(H,32,37);6-10,17,20,22,25-26H,11-16,18-19H2,1-5H3,(H,32,37);6-8,15-16,18,20,24-25H,9-14,17H2,1-5H3,(H,32,37);4-11,21,23-24H,12-18H2,1-3H3,(H,28,31)/t;;;21?,24-/m...0/s1.

What are the key properties of 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide?

6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide has a molecular weight of 2154.67 g/mol, XLogP of 22.32, 32 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-N-[3-[4-[5-(3-chlorophenyl)-3-propan-2-yl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-N-[3-[4-(3-cyclohexyl-2-oxo-5-thiophen-3-ylimidazolidin-1-yl)piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide;6-chloro-2,4-dimethyl-N-[3-[4-[3-(2-methylpropyl)-5-phenyl-2-sulfanylideneimidazolidin-1-yl]piperidin-1-yl]butyl]pyridine-3-carboxamide;2,6-dimethyl-N-[3-[4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidin-1-yl]butyl]benzamide is sourced from PubChem (CID 159479304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).