3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide

C103H94Cl4F9N15O12S5 — CID 158483813

About 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide

3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide (PubChem CID 158483813) has the molecular formula C103H94Cl4F9N15O12S5 and a molecular weight of 2207.11 g/mol. Its IUPAC name is 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide.

Molecular Properties

• Compound Name: 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide
• PubChem CID: 158483813
• Molecular Formula: C103H94Cl4F9N15O12S5
• Molecular Weight: 2207.11 g/mol
• Exact Mass: 2203.44
• IUPAC Name: 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide
• SMILES: CCCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(Cl)ccc3n2CC)cc1.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)(F)F)cc3n2CC2CC2)cc1.CCn1c(-c2ccc(NS(=O)(=O)CC(F)(F)F)cc2)c(C#N)c2cc(Cl)ccc21.CCn1c(-c2ccc(NS(=O)(=O)CCCCl)cc2)c(C#N)c2cc(Cl)ccc21.CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)(F)F)cc3n2CC2CC2)cc1
• InChI: InChI=1S/C22H20F3N3O3S.C21H22ClN3O2S.C21H18F3N3O3S.C20H19Cl2N3O2S.C19H15ClF3N3O2S/c1-2-32(29,30)27-16-7-5-15(6-8-16)21-19(12-26)18-10-9-17(31-22(23,24)25)11-20(18)28(21)13-14-3-4-14;1-3-5-12-28(26,27)24-17-9-6-15(7-10-17)21-19(14-23)18-13-16(22)8-11-20(18)25(21)4-2;1-31(28,29)26-15-6-4-14(5-7-15)20-18(11-25)17-9-8-16(30-21(22,23)24)10-19(17)27(20)12-13-2-3-13;1-2-25-19-9-6-15(22)12-17(19)18(13-23)20(25)14-4-7-16(8-5-14)24-28(26,27)11-3-10-21;1-2-26-17-8-5-13(20)9-15(17)16(10-24)18(26)12-3-6-14(7-4-12)25-29(27,28)11-19(21,22)23/h5-11,14,27H,2-4,13H2,1H3;6-11,13,24H,3-5,12H2,1-2H3;4-10,13,26H,2-3,12H2,1H3;4-9,12,24H,2-3,10-11H2,1H3;3-9,25H,2,11H2,1H3
• InChIKey: HHVNYZYOCXWYHQ-UHFFFAOYSA-N
• XLogP: 25.89
• TPSA: 392.91 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 22
• Rotatable Bonds: 32
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2207.11
LogP ≤ 5	25.89
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide?

The IUPAC name of 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide (CID 158483813) is 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide.

What is the SMILES notation for 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide?

The canonical SMILES for 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide is CCCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(Cl)ccc3n2CC)cc1.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)(F)F)cc3n2CC2CC2)cc1.CCn1c(-c2ccc(NS(=O)(=O)CC(F)(F)F)cc2)c(C#N)c2cc(Cl)ccc21.CCn1c(-c2ccc(NS(=O)(=O)CCCCl)cc2)c(C#N)c2cc(Cl)ccc21.CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)(F)F)cc3n2CC2CC2)cc1.

What is the InChIKey of 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide?

The InChIKey is HHVNYZYOCXWYHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F3N3O3S.C21H22ClN3O2S.C21H18F3N3O3S.C20H19Cl2N3O2S.C19H15ClF3N3O2S/c1-2-32(29,30)27-16-7-5-15(6-8-16)21-19(12-26)18-10-9-17(31-22(23,24)25)11-20(18)28(21)13-14-3-4-14;1-3-5-12-28(26,27)24-17-9-6-15(7-10-17)21-19(14-23)18-13-16(22)8-11-20(18)25(21)4-2;1-31(28,29)26-15-6-4-14(5-7-15)20-18(11-25)17-9-8-16(30-21(22,23)24)10-19(17)27(20)12-13-2-3-13;1-2-25-19-9-6-15(22)12-17(19)18(13-23)20(25)14-4-7-16(8-5-14)24-28(26,27)11-3-10-21;1-2-26-17-8-5-13(20)9-15(17)16(10-24)18(26)12-3-6-14(7-4-12)25-29(27,28)11-19(21,22)23/h5-11,14,27H,2-4,13H2,1H3;6-11,13,24H,3-5,12H2,1-2H3;4-10,13,26H,2-3,12H2,1H3;4-9,12,24H,2-3,10-11H2,1H3;3-9,25H,2,11H2,1H3.

What are the key properties of 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide?

3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide has a molecular weight of 2207.11 g/mol, XLogP of 25.89, 32 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]butane-1-sulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]-2,2,2-trifluoroethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide is sourced from PubChem (CID 158483813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).