N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate

C147H140ClF9N22O18S4 — CID 158047869

About N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate

N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate (PubChem CID 158047869) has the molecular formula C147H140ClF9N22O18S4 and a molecular weight of 2837.58 g/mol. Its IUPAC name is N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate.

Molecular Properties

• Compound Name: N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate
• PubChem CID: 158047869
• Molecular Formula: C147H140ClF9N22O18S4
• Molecular Weight: 2837.58 g/mol
• Exact Mass: 2834.91
• IUPAC Name: N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate
• SMILES: CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1Cl.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1F.CC(C)n1c(-c2ccc(N3CCCS3(=O)=O)cc2)c(C#N)c2ccc(OC(F)F)cc21.CC(C)n1c(-c2ccc(NS(=O)(=O)C3CCC3)cc2)c(C#N)c2ccc(OC(F)F)cc21.CC1(S(=O)(=O)Nc2ccc(-c3c(C#N)c4ccc(OC(F)F)cc4n3C3CCC3)cc2)CC1.CCC1(S(=O)(=O)Nc2ccc(-c3c(C#N)c4ccc(OC(F)F)cc4n3C(C)C)cc2)CC1
• InChI: InChI=1S/C27H24ClN5O3.C27H24FN5O3.C24H23F2N3O3S.C24H25F2N3O3S.C23H23F2N3O3S.C22H21F2N3O3S/c2*1-16(2)35-27(34)32-23-10-7-17(13-22(23)28)25-21(15-29)20-9-8-19(36-26-30-11-4-12-31-26)14-24(20)33(25)18-5-3-6-18;1-24(11-12-24)33(30,31)28-16-7-5-15(6-8-16)22-20(14-27)19-10-9-18(32-23(25)26)13-21(19)29(22)17-3-2-4-17;1-4-24(11-12-24)33(30,31)28-17-7-5-16(6-8-17)22-20(14-27)19-10-9-18(32-23(25)26)13-21(19)29(22)15(2)3;1-14(2)28-21-12-17(31-23(24)25)10-11-19(21)20(13-26)22(28)15-6-8-16(9-7-15)27-32(29,30)18-4-3-5-18;1-14(2)27-20-12-17(30-22(23)24)8-9-18(20)19(13-25)21(27)15-4-6-16(7-5-15)26-10-3-11-31(26,28)29/h2*4,7-14,16,18H,3,5-6H2,1-2H3,(H,32,34);5-10,13,17,23,28H,2-4,11-12H2,1H3;5-10,13,15,23,28H,4,11-12H2,1-3H3;6-12,14,18,23,27H,3-5H2,1-2H3;4-9,12,14,22H,3,10-11H2,1-2H3
• InChIKey: FJDAFJRLLZVSRL-UHFFFAOYSA-N
• XLogP: 36.09
• TPSA: 531.81 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 34
• Rotatable Bonds: 39
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2837.58
LogP ≤ 5	36.09
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate?

The IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate (CID 158047869) is N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate.

What is the SMILES notation for N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate?

The canonical SMILES for N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1Cl.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1F.CC(C)n1c(-c2ccc(N3CCCS3(=O)=O)cc2)c(C#N)c2ccc(OC(F)F)cc21.CC(C)n1c(-c2ccc(NS(=O)(=O)C3CCC3)cc2)c(C#N)c2ccc(OC(F)F)cc21.CC1(S(=O)(=O)Nc2ccc(-c3c(C#N)c4ccc(OC(F)F)cc4n3C3CCC3)cc2)CC1.CCC1(S(=O)(=O)Nc2ccc(-c3c(C#N)c4ccc(OC(F)F)cc4n3C(C)C)cc2)CC1.

What is the InChIKey of N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate?

The InChIKey is FJDAFJRLLZVSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24ClN5O3.C27H24FN5O3.C24H23F2N3O3S.C24H25F2N3O3S.C23H23F2N3O3S.C22H21F2N3O3S/c2*1-16(2)35-27(34)32-23-10-7-17(13-22(23)28)25-21(15-29)20-9-8-19(36-26-30-11-4-12-31-26)14-24(20)33(25)18-5-3-6-18;1-24(11-12-24)33(30,31)28-16-7-5-15(6-8-16)22-20(14-27)19-10-9-18(32-23(25)26)13-21(19)29(22)17-3-2-4-17;1-4-24(11-12-24)33(30,31)28-17-7-5-16(6-8-17)22-20(14-27)19-10-9-18(32-23(25)26)13-21(19)29(22)15(2)3;1-14(2)28-21-12-17(31-23(24)25)10-11-19(21)20(13-26)22(28)15-6-8-16(9-7-15)27-32(29,30)18-4-3-5-18;1-14(2)27-20-12-17(30-22(23)24)8-9-18(20)19(13-25)21(27)15-4-6-16(7-5-15)26-10-3-11-31(26,28)29/h2*4,7-14,16,18H,3,5-6H2,1-2H3,(H,32,34);5-10,13,17,23,28H,2-4,11-12H2,1H3;5-10,13,15,23,28H,4,11-12H2,1-3H3;6-12,14,18,23,27H,3-5H2,1-2H3;4-9,12,14,22H,3,10-11H2,1-2H3.

What are the key properties of N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate?

N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate has a molecular weight of 2837.58 g/mol, XLogP of 36.09, 39 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]-1-methylcyclopropane-1-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;6-(difluoromethoxy)-2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propan-2-ylindole-3-carbonitrile;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate is sourced from PubChem (CID 158047869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).