A1L5O

N-cycloheptyl-4,6-dimethyl-1H-indole-2-carboxamide

Created:	2024-11-08
Last modified:	2025-11-05

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1 entries where A1L5O is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	45
Chiral Atom Count	0
Bond Count	47
Aromatic Bond Count	10

2D diagram of A1L5O

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Chemical Component Summary
Name	N-cycloheptyl-4,6-dimethyl-1H-indole-2-carboxamide
Systematic Name (OpenEye OEToolkits)	~{N}-cycloheptyl-4,6-dimethyl-1~{H}-indole-2-carboxamide
Formula	C₁₈ H₂₄ N₂ O
Molecular Weight	284.396
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1cc(C)c2cc([nH]c2c1)C(=O)NC3CCCCCC3
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(c2cc([nH]c2c1)C(=O)NC3CCCCCC3)C
Canonical SMILES	CACTVS	3.385	Cc1cc(C)c2cc([nH]c2c1)C(=O)NC3CCCCCC3
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(c2cc([nH]c2c1)C(=O)NC3CCCCCC3)C
InChI	InChI	1.06	InChI=1S/C18H24N2O/c1-12-9-13(2)15-11-17(20-16(15)10-12)18(21)19-14-7-5-3-4-6-8-14/h9-11,14,20H,3-8H2,1-2H3,(H,19,21)
InChIKey	InChI	1.06	ANRDRZQBFPDAJD-UHFFFAOYSA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.