N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide

C90H88Cl3N7O15S3 — CID 163789413

About N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide

N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide (PubChem CID 163789413) has the molecular formula C90H88Cl3N7O15S3 and a molecular weight of 1710.29 g/mol. Its IUPAC name is N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide.

Molecular Properties

• Compound Name: N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide
• PubChem CID: 163789413
• Molecular Formula: C90H88Cl3N7O15S3
• Molecular Weight: 1710.29 g/mol
• Exact Mass: 1707.46
• IUPAC Name: N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide
• SMILES: Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3ccc4ccccc4c3)Cc3ccccc32)cc(C)c1Cl.Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3ccccc3)Cc3ccccc32)cc(C)c1Cl.Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3cccnc3)Cc3ccccc32)cc(C)c1Cl
• InChI: InChI=1S/C33H31ClN2O5S.C29H29ClN2O5S.C28H28ClN3O5S/c1-21-16-26(17-22(2)32(21)34)41-15-7-12-29-28-11-6-5-10-25(28)19-30(29)33(38)35-20-31(37)36-42(39,40)27-14-13-23-8-3-4-9-24(23)18-27;1-19-15-22(16-20(2)28(19)30)37-14-8-13-25-24-12-7-6-9-21(24)17-26(25)29(34)31-18-27(33)32-38(35,36)23-10-4-3-5-11-23;1-18-13-21(14-19(2)27(18)29)37-12-6-10-24-23-9-4-3-7-20(23)15-25(24)28(34)31-17-26(33)32-38(35,36)22-8-5-11-30-16-22/h3-6,8-11,13-14,16-18H,7,12,15,19-20H2,1-2H3,(H,35,38)(H,36,37);3-7,9-12,15-16H,8,13-14,17-18H2,1-2H3,(H,31,34)(H,32,33);3-5,7-9,11,13-14,16H,6,10,12,15,17H2,1-2H3,(H,31,34)(H,32,33)
• InChIKey: MVJKBSNFEBEUDQ-UHFFFAOYSA-N
• XLogP: 14.79
• TPSA: 317.60 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 16
• Rotatable Bonds: 30
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1710.29
LogP ≤ 5	14.79
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide?

The IUPAC name of N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide (CID 163789413) is N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide.

What is the SMILES notation for N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide?

The canonical SMILES for N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide is Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3ccc4ccccc4c3)Cc3ccccc32)cc(C)c1Cl.Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3ccccc3)Cc3ccccc32)cc(C)c1Cl.Cc1cc(OCCCC2=C(C(=O)NCC(=O)NS(=O)(=O)c3cccnc3)Cc3ccccc32)cc(C)c1Cl.

What is the InChIKey of N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide?

The InChIKey is MVJKBSNFEBEUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H31ClN2O5S.C29H29ClN2O5S.C28H28ClN3O5S/c1-21-16-26(17-22(2)32(21)34)41-15-7-12-29-28-11-6-5-10-25(28)19-30(29)33(38)35-20-31(37)36-42(39,40)27-14-13-23-8-3-4-9-24(23)18-27;1-19-15-22(16-20(2)28(19)30)37-14-8-13-25-24-12-7-6-9-21(24)17-26(25)29(34)31-18-27(33)32-38(35,36)23-10-4-3-5-11-23;1-18-13-21(14-19(2)27(18)29)37-12-6-10-24-23-9-4-3-7-20(23)15-25(24)28(34)31-17-26(33)32-38(35,36)22-8-5-11-30-16-22/h3-6,8-11,13-14,16-18H,7,12,15,19-20H2,1-2H3,(H,35,38)(H,36,37);3-7,9-12,15-16H,8,13-14,17-18H2,1-2H3,(H,31,34)(H,32,33);3-5,7-9,11,13-14,16H,6,10,12,15,17H2,1-2H3,(H,31,34)(H,32,33).

What are the key properties of N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide?

N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide has a molecular weight of 1710.29 g/mol, XLogP of 14.79, 30 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(benzenesulfonamido)-2-oxoethyl]-3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-(naphthalen-2-ylsulfonylamino)-2-oxoethyl]-1H-indene-2-carboxamide;3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-N-[2-oxo-2-(pyridin-3-ylsulfonylamino)ethyl]-1H-indene-2-carboxamide is sourced from PubChem (CID 163789413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).