N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate

C163H167F10N19O24S8 — CID 162072931

About N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate

N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate (PubChem CID 162072931) has the molecular formula C163H167F10N19O24S8 and a molecular weight of 3222.75 g/mol. Its IUPAC name is N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate.

Molecular Properties

• Compound Name: N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate
• PubChem CID: 162072931
• Molecular Formula: C163H167F10N19O24S8
• Molecular Weight: 3222.75 g/mol
• Exact Mass: 3220.00
• IUPAC Name: N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate
• SMILES: CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1)C(F)(F)F.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(N(CCF)c3nc(C(F)(F)F)cs3)cc2)n(C2CCC2)c2cc(OCCF)ccc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OC3CCS(=O)(=O)CC3)ccc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CCCC3)cc2)n(CC2CC2)c2cc(OC(F)F)ccc12
• InChI: InChI=1S/C30H33N3O5S.C28H28F3N3O5S.C27H23F5N4OS.C27H29N3O5S2.C26H29N3O5S2.C25H25F2N3O3S/c1-19(20-5-6-20)37-30(34)32-22-9-7-21(8-10-22)29-27(18-31)26-12-11-25(17-28(26)33(29)23-3-2-4-23)38-24-13-15-39(35,36)16-14-24;1-17(28(29,30)31)38-27(35)33-19-7-5-18(6-8-19)26-24(16-32)23-10-9-22(15-25(23)34(26)20-3-2-4-20)39-21-11-13-40(36,37)14-12-21;28-10-12-35(26-34-24(16-38-26)27(30,31)32)18-6-4-17(5-7-18)25-22(15-33)21-9-8-20(37-13-11-29)14-23(21)36(25)19-2-1-3-19;28-17-25-24-11-8-22(35-21-12-14-36(31,32)15-13-21)16-26(24)30(20-2-1-3-20)27(25)18-4-6-19(7-5-18)29-37(33,34)23-9-10-23;1-2-36(32,33)28-19-8-6-18(7-9-19)26-24(17-27)23-11-10-22(16-25(23)29(26)20-4-3-5-20)34-21-12-14-35(30,31)15-13-21;26-25(27)33-19-11-12-21-22(14-28)24(30(23(21)13-19)15-16-5-6-16)17-7-9-18(10-8-17)29-34(31,32)20-3-1-2-4-20/h7-12,17,19-20,23-24H,2-6,13-16H2,1H3,(H,32,34);5-10,15,17,20-21H,2-4,11-14H2,1H3,(H,33,35);4-9,14,16,19H,1-3,10-13H2;4-8,11,16,20-21,23,29H,1-3,9-10,12-15H2;6-11,16,20-21,28H,2-5,12-15H2,1H3;7-13,16,20,25,29H,1-6,15H2/t19-;17-;;;;/m11..../s1
• InChIKey: ZBIICHICFQKWCU-UTFNREPXSA-N
• XLogP: 35.67
• TPSA: 595.56 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 39
• Rotatable Bonds: 44
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3222.75
LogP ≤ 5	35.67
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate?

The IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate (CID 162072931) is N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate.

What is the SMILES notation for N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate?

The canonical SMILES for N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate is CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1)C(F)(F)F.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCS(=O)(=O)CC4)cc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(N(CCF)c3nc(C(F)(F)F)cs3)cc2)n(C2CCC2)c2cc(OCCF)ccc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OC3CCS(=O)(=O)CC3)ccc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CCCC3)cc2)n(CC2CC2)c2cc(OC(F)F)ccc12.

What is the InChIKey of N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate?

The InChIKey is ZBIICHICFQKWCU-UTFNREPXSA-N. The full InChI is InChI=1S/C30H33N3O5S.C28H28F3N3O5S.C27H23F5N4OS.C27H29N3O5S2.C26H29N3O5S2.C25H25F2N3O3S/c1-19(20-5-6-20)37-30(34)32-22-9-7-21(8-10-22)29-27(18-31)26-12-11-25(17-28(26)33(29)23-3-2-4-23)38-24-13-15-39(35,36)16-14-24;1-17(28(29,30)31)38-27(35)33-19-7-5-18(6-8-19)26-24(16-32)23-10-9-22(15-25(23)34(26)20-3-2-4-20)39-21-11-13-40(36,37)14-12-21;28-10-12-35(26-34-24(16-38-26)27(30,31)32)18-6-4-17(5-7-18)25-22(15-33)21-9-8-20(37-13-11-29)14-23(21)36(25)19-2-1-3-19;28-17-25-24-11-8-22(35-21-12-14-36(31,32)15-13-21)16-26(24)30(20-2-1-3-20)27(25)18-4-6-19(7-5-18)29-37(33,34)23-9-10-23;1-2-36(32,33)28-19-8-6-18(7-9-19)26-24(17-27)23-11-10-22(16-25(23)29(26)20-4-3-5-20)34-21-12-14-35(30,31)15-13-21;26-25(27)33-19-11-12-21-22(14-28)24(30(23(21)13-19)15-16-5-6-16)17-7-9-18(10-8-17)29-34(31,32)20-3-1-2-4-20/h7-12,17,19-20,23-24H,2-6,13-16H2,1H3,(H,32,34);5-10,15,17,20-21H,2-4,11-14H2,1H3,(H,33,35);4-9,14,16,19H,1-3,10-13H2;4-8,11,16,20-21,23,29H,1-3,9-10,12-15H2;6-11,16,20-21,28H,2-5,12-15H2,1H3;7-13,16,20,25,29H,1-6,15H2/t19-;17-;;;;/m11..../s1.

What are the key properties of N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate?

N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate has a molecular weight of 3222.75 g/mol, XLogP of 35.67, 44 rotatable bonds, 5 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopentanesulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[2-fluoroethyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(1,1-dioxothian-4-yl)oxyindol-2-yl]phenyl]carbamate is sourced from PubChem (CID 162072931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).