(5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one

C₁₅₆H₁₃₄F₄N₂₀O₆ — CID 159008751

About (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one

(5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one (PubChem CID 159008751) has the molecular formula C₁₅₆H₁₃₄F₄N₂₀O₆ and a molecular weight of 2460.91 g/mol. Its IUPAC name is (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one.

Molecular Properties

• Compound Name: (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one
• PubChem CID: 159008751
• Molecular Formula: C₁₅₆H₁₃₄F₄N₂₀O₆
• Molecular Weight: 2460.91 g/mol
• Exact Mass: 2459.07
• IUPAC Name: (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one
• SMILES: [C-]#[N+]C1=C[C@@]2(C)c3nc(-c4ccc(-c5ccccc5)cc4)n(-c4cccnc4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5c(C)coc5C)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cccn5C)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cncc(C)c5)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cnn(C)c5)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O
• InChI: InChI=1S/C32H27FN4O.C32H28FN3O2.C31H27FN4O.C31H26N4O.C30H26FN5O/c1-19-13-23(18-35-17-19)21-7-5-8-22(14-21)31-36-30-28(37(31)25-10-6-9-24(33)15-25)12-11-26-20(2)29(38)27(34-4)16-32(26,30)3;1-18-17-38-20(3)28(18)21-8-6-9-22(14-21)31-35-30-27(36(31)24-11-7-10-23(33)15-24)13-12-25-19(2)29(37)26(34-5)16-32(25,30)4;1-19-24-13-14-27-29(31(24,2)18-25(33-3)28(19)37)34-30(36(27)23-11-6-10-22(32)17-23)21-9-5-8-20(16-21)26-12-7-15-35(26)4;1-20-25-15-16-27-29(31(25,2)18-26(32-3)28(20)36)34-30(35(27)24-10-7-17-33-19-24)23-13-11-22(12-14-23)21-8-5-4-6-9-21;1-18-24-11-12-26-28(30(24,2)15-25(32-3)27(18)37)34-29(36(26)23-10-6-9-22(31)14-23)20-8-5-7-19(13-20)21-16-33-35(4)17-21/h5-10,13-18,20,26H,11-12H2,1-3H3;6-11,14-17,19,25H,12-13H2,1-4H3;5-12,15-19,24H,13-14H2,1-2,4H3;4-14,17-20,25H,15-16H2,1-2H3;5-10,13-18,24H,11-12H2,1-2,4H3/t20-,26-,32-;19-,25-,32-;19-,24-,31-;20-,25-,31-;18-,24-,30-/m11111/s1
• InChIKey: JSGAUHZQQKVQNK-BRRQYBKRSA-N
• XLogP: 33.18
• TPSA: 257.92 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 15
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2460.91
LogP ≤ 5	33.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one?

The IUPAC name of (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one (CID 159008751) is (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one.

What is the SMILES notation for (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one?

The canonical SMILES for (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one is [C-]#[N+]C1=C[C@@]2(C)c3nc(-c4ccc(-c5ccccc5)cc4)n(-c4cccnc4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5c(C)coc5C)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cccn5C)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cncc(C)c5)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.[C-]#[N+]C1=C[C@@]2(C)c3nc(-c4cccc(-c5cnn(C)c5)c4)n(-c4cccc(F)c4)c3CC[C@@H]2[C@@H](C)C1=O.

What is the InChIKey of (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one?

The InChIKey is JSGAUHZQQKVQNK-BRRQYBKRSA-N. The full InChI is InChI=1S/C32H27FN4O.C32H28FN3O2.C31H27FN4O.C31H26N4O.C30H26FN5O/c1-19-13-23(18-35-17-19)21-7-5-8-22(14-21)31-36-30-28(37(31)25-10-6-9-24(33)15-25)12-11-26-20(2)29(38)27(34-4)16-32(26,30)3;1-18-17-38-20(3)28(18)21-8-6-9-22(14-21)31-35-30-27(36(31)24-11-7-10-23(33)15-24)13-12-25-19(2)29(37)26(34-5)16-32(25,30)4;1-19-24-13-14-27-29(31(24,2)18-25(33-3)28(19)37)34-30(36(27)23-11-6-10-22(32)17-23)21-9-5-8-20(16-21)26-12-7-15-35(26)4;1-20-25-15-16-27-29(31(25,2)18-26(32-3)28(20)36)34-30(35(27)24-10-7-17-33-19-24)23-13-11-22(12-14-23)21-8-5-4-6-9-21;1-18-24-11-12-26-28(30(24,2)15-25(32-3)27(18)37)34-29(36(26)23-10-6-9-22(31)14-23)20-8-5-7-19(13-20)21-16-33-35(4)17-21/h5-10,13-18,20,26H,11-12H2,1-3H3;6-11,14-17,19,25H,12-13H2,1-4H3;5-12,15-19,24H,13-14H2,1-2,4H3;4-14,17-20,25H,15-16H2,1-2H3;5-10,13-18,24H,11-12H2,1-2,4H3/t20-,26-,32-;19-,25-,32-;19-,24-,31-;20-,25-,31-;18-,24-,30-/m11111/s1.

What are the key properties of (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one?

(5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one has a molecular weight of 2460.91 g/mol, XLogP of 33.18, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for (5aR,6R,9aS)-2-[3-(2,4-dimethylfuran-3-yl)phenyl]-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrazol-4-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(5-methyl-3-pyridinyl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-3-(3-fluorophenyl)-8-isocyano-6,9a-dimethyl-2-[3-(1-methylpyrrol-2-yl)phenyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one;(5aR,6R,9aS)-8-isocyano-6,9a-dimethyl-2-(4-phenylphenyl)-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[e]benzimidazol-7-one is sourced from PubChem (CID 159008751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159008751 — identifiers, structure, computed properties (public domain)

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