6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile

C147H139F6N23O15S6 — CID 158626621

About 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile

6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile (PubChem CID 158626621) has the molecular formula C147H139F6N23O15S6 and a molecular weight of 2774.26 g/mol. Its IUPAC name is 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile.

Molecular Properties

• Compound Name: 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile
• PubChem CID: 158626621
• Molecular Formula: C147H139F6N23O15S6
• Molecular Weight: 2774.26 g/mol
• Exact Mass: 2771.90
• IUPAC Name: 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile
• SMILES: CC(C)n1c(-c2ccc(N3CCCS3(=O)=O)cc2)c(C#N)c2ccc(OCC(F)(F)F)cc21.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4cnccn4)cc3n2C2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccn4)cc3n2C2CC2)cc1.CC[C@@H](C)Oc1ccc2c(C#N)c(-c3ccc(N4CCCS4(=O)=O)cc3)n(C3CC3)c2c1.N#Cc1c(-c2ccc(N3CCCS3(=O)=O)cc2)n(C2CC2)c2cc(OCC(F)(F)F)ccc12
• InChI: InChI=1S/C26H24N4O2S.2C25H23N5O2S.C25H27N3O3S.C23H20F3N3O3S.C23H22F3N3O3S/c1-2-15-33(31,32)29-20-9-6-18(7-10-20)26-23(17-27)22-13-8-19(24-5-3-4-14-28-24)16-25(22)30(26)21-11-12-21;1-2-14-33(31,32)29-19-7-4-17(5-8-19)24-22(16-26)21-11-6-18(25-27-12-3-13-28-25)15-23(21)30(24)20-9-10-20;1-2-13-33(31,32)29-19-6-3-17(4-7-19)25-22(15-26)21-10-5-18(23-16-27-11-12-28-23)14-24(21)30(25)20-8-9-20;1-3-17(2)31-21-11-12-22-23(16-26)25(28(20-9-10-20)24(22)15-21)18-5-7-19(8-6-18)27-13-4-14-32(27,29)30;24-23(25,26)14-32-18-8-9-19-20(13-27)22(29(17-6-7-17)21(19)12-18)15-2-4-16(5-3-15)28-10-1-11-33(28,30)31;1-15(2)29-21-12-18(32-14-23(24,25)26)8-9-19(21)20(13-27)22(29)16-4-6-17(7-5-16)28-10-3-11-33(28,30)31/h3-10,13-14,16,21,29H,2,11-12,15H2,1H3;3-8,11-13,15,20,29H,2,9-10,14H2,1H3;3-7,10-12,14,16,20,29H,2,8-9,13H2,1H3;5-8,11-12,15,17,20H,3-4,9-10,13-14H2,1-2H3;2-5,8-9,12,17H,1,6-7,10-11,14H2;4-9,12,15H,3,10-11,14H2,1-2H3/t;;;17-;;/m...1../s1
• InChIKey: HYRBTLCXPCOMEO-NIXFMSLKSA-N
• XLogP: 31.45
• TPSA: 515.11 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 32
• Rotatable Bonds: 37
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2774.26
LogP ≤ 5	31.45
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile?

The IUPAC name of 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile (CID 158626621) is 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile.

What is the SMILES notation for 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile?

The canonical SMILES for 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile is CC(C)n1c(-c2ccc(N3CCCS3(=O)=O)cc2)c(C#N)c2ccc(OCC(F)(F)F)cc21.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4cnccn4)cc3n2C2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccn4)cc3n2C2CC2)cc1.CC[C@@H](C)Oc1ccc2c(C#N)c(-c3ccc(N4CCCS4(=O)=O)cc3)n(C3CC3)c2c1.N#Cc1c(-c2ccc(N3CCCS3(=O)=O)cc2)n(C2CC2)c2cc(OCC(F)(F)F)ccc12.

What is the InChIKey of 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile?

The InChIKey is HYRBTLCXPCOMEO-NIXFMSLKSA-N. The full InChI is InChI=1S/C26H24N4O2S.2C25H23N5O2S.C25H27N3O3S.C23H20F3N3O3S.C23H22F3N3O3S/c1-2-15-33(31,32)29-20-9-6-18(7-10-20)26-23(17-27)22-13-8-19(24-5-3-4-14-28-24)16-25(22)30(26)21-11-12-21;1-2-14-33(31,32)29-19-7-4-17(5-8-19)24-22(16-26)21-11-6-18(25-27-12-3-13-28-25)15-23(21)30(24)20-9-10-20;1-2-13-33(31,32)29-19-6-3-17(4-7-19)25-22(15-26)21-10-5-18(23-16-27-11-12-28-23)14-24(21)30(25)20-8-9-20;1-3-17(2)31-21-11-12-22-23(16-26)25(28(20-9-10-20)24(22)15-21)18-5-7-19(8-6-18)27-13-4-14-32(27,29)30;24-23(25,26)14-32-18-8-9-19-20(13-27)22(29(17-6-7-17)21(19)12-18)15-2-4-16(5-3-15)28-10-1-11-33(28,30)31;1-15(2)29-21-12-18(32-14-23(24,25)26)8-9-19(21)20(13-27)22(29)16-4-6-17(7-5-16)28-10-3-11-33(28,30)31/h3-10,13-14,16,21,29H,2,11-12,15H2,1H3;3-8,11-13,15,20,29H,2,9-10,14H2,1H3;3-7,10-12,14,16,20,29H,2,8-9,13H2,1H3;5-8,11-12,15,17,20H,3-4,9-10,13-14H2,1-2H3;2-5,8-9,12,17H,1,6-7,10-11,14H2;4-9,12,15H,3,10-11,14H2,1-2H3/t;;;17-;;/m...1../s1.

What are the key properties of 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile?

6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile has a molecular weight of 2774.26 g/mol, XLogP of 31.45, 37 rotatable bonds, 3 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(2R)-butan-2-yl]oxy-1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]indole-3-carbonitrile;N-[4-(3-cyano-1-cyclopropyl-6-pyrazin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyridin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclopropyl-6-pyrimidin-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;1-cyclopropyl-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-yl-6-(2,2,2-trifluoroethoxy)indole-3-carbonitrile is sourced from PubChem (CID 158626621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).