4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate

C125H124ClN19O18S5 — CID 158705520

About 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate

4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate (PubChem CID 158705520) has the molecular formula C125H124ClN19O18S5 and a molecular weight of 2376.27 g/mol. Its IUPAC name is 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate.

Molecular Properties

• Compound Name: 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate
• PubChem CID: 158705520
• Molecular Formula: C125H124ClN19O18S5
• Molecular Weight: 2376.27 g/mol
• Exact Mass: 2373.77
• IUPAC Name: 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate
• SMILES: CCOC(=O)c1ccc(NC(=O)Nc2cccc(-c3c(C#N)c4ccc(OC)cc4n3CC)c2)cc1.CCOc1ccc2c(C#N)c(-c3ccc(NS(=O)(=O)CC)cc3)n(C)c2c1.CCOc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(C)c2c1.CCOc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(CC)c2c1.CCn1c(-c2ccc(S(N)(=O)=O)cc2)c(C#N)c2cc(Cl)ccc21.COc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(CC(C)C)c2c1
• InChI: InChI=1S/C28H26N4O4.C21H23N3O3S.2C20H21N3O3S.C19H19N3O3S.C17H14ClN3O2S/c1-4-32-25-16-22(35-3)13-14-23(25)24(17-29)26(32)19-7-6-8-21(15-19)31-28(34)30-20-11-9-18(10-12-20)27(33)36-5-2;1-14(2)13-24-20-11-17(27-3)9-10-18(20)19(12-22)21(24)15-5-7-16(8-6-15)23-28(4,25)26;1-4-23-19-12-16(26-5-2)10-11-17(19)18(13-21)20(23)14-6-8-15(9-7-14)22-27(3,24)25;1-4-26-16-10-11-17-18(13-21)20(23(3)19(17)12-16)14-6-8-15(9-7-14)22-27(24,25)5-2;1-4-25-15-9-10-16-17(12-20)19(22(2)18(16)11-15)13-5-7-14(8-6-13)21-26(3,23)24;1-2-21-16-8-5-12(18)9-14(16)15(10-19)17(21)11-3-6-13(7-4-11)24(20,22)23/h6-16H,4-5H2,1-3H3,(H2,30,31,34);5-11,14,23H,13H2,1-4H3;2*6-12,22H,4-5H2,1-3H3;5-11,21H,4H2,1-3H3;3-9H,2H2,1H3,(H2,20,22,23)
• InChIKey: IIBIHAKZEFLHSE-UHFFFAOYSA-N
• XLogP: 25.08
• TPSA: 530.74 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 30
• Rotatable Bonds: 33
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2376.27
LogP ≤ 5	25.08
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate?

The IUPAC name of 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate (CID 158705520) is 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate.

What is the SMILES notation for 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate?

The canonical SMILES for 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate is CCOC(=O)c1ccc(NC(=O)Nc2cccc(-c3c(C#N)c4ccc(OC)cc4n3CC)c2)cc1.CCOc1ccc2c(C#N)c(-c3ccc(NS(=O)(=O)CC)cc3)n(C)c2c1.CCOc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(C)c2c1.CCOc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(CC)c2c1.CCn1c(-c2ccc(S(N)(=O)=O)cc2)c(C#N)c2cc(Cl)ccc21.COc1ccc2c(C#N)c(-c3ccc(NS(C)(=O)=O)cc3)n(CC(C)C)c2c1.

What is the InChIKey of 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate?

The InChIKey is IIBIHAKZEFLHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26N4O4.C21H23N3O3S.2C20H21N3O3S.C19H19N3O3S.C17H14ClN3O2S/c1-4-32-25-16-22(35-3)13-14-23(25)24(17-29)26(32)19-7-6-8-21(15-19)31-28(34)30-20-11-9-18(10-12-20)27(33)36-5-2;1-14(2)13-24-20-11-17(27-3)9-10-18(20)19(12-22)21(24)15-5-7-16(8-6-15)23-28(4,25)26;1-4-23-19-12-16(26-5-2)10-11-17(19)18(13-21)20(23)14-6-8-15(9-7-14)22-27(3,24)25;1-4-26-16-10-11-17-18(13-21)20(23(3)19(17)12-16)14-6-8-15(9-7-14)22-27(24,25)5-2;1-4-25-15-9-10-16-17(12-20)19(22(2)18(16)11-15)13-5-7-14(8-6-13)21-26(3,23)24;1-2-21-16-8-5-12(18)9-14(16)15(10-19)17(21)11-3-6-13(7-4-11)24(20,22)23/h6-16H,4-5H2,1-3H3,(H2,30,31,34);5-11,14,23H,13H2,1-4H3;2*6-12,22H,4-5H2,1-3H3;5-11,21H,4H2,1-3H3;3-9H,2H2,1H3,(H2,20,22,23).

What are the key properties of 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate?

4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate has a molecular weight of 2376.27 g/mol, XLogP of 25.08, 33 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(5-chloro-3-cyano-1-ethylindol-2-yl)benzenesulfonamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-methylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-6-methoxy-1-(2-methylpropyl)indol-2-yl]phenyl]methanesulfonamide;ethyl 4-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamoylamino]benzoate is sourced from PubChem (CID 158705520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).