5LA

2-chloranyl-6~{H}-thieno[2,3-b]pyrrole-5-carboxylic acid

Created:	2015-10-19
Last modified:	2016-10-26

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1 entries where 5LA is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	17
Aromatic Bond Count	9

2D diagram of 5LA

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Chemical Component Summary
Name	2-chloranyl-6~{H}-thieno[2,3-b]pyrrole-5-carboxylic acid
Systematic Name (OpenEye OEToolkits)	2-chloranyl-6~{H}-thieno[2,3-b]pyrrole-5-carboxylic acid
Formula	C₇ H₄ Cl N O₂ S
Molecular Weight	201.63
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1[nH]c2sc(Cl)cc2c1
SMILES	OpenEye OEToolkits	2.0.4	c1c2cc(sc2[nH]c1C(=O)O)Cl
Canonical SMILES	CACTVS	3.385	OC(=O)c1[nH]c2sc(Cl)cc2c1
Canonical SMILES	OpenEye OEToolkits	2.0.4	c1c2cc(sc2[nH]c1C(=O)O)Cl
InChI	InChI	1.03	InChI=1S/C7H4ClNO2S/c8-5-2-3-1-4(7(10)11)9-6(3)12-5/h1-2,9H,(H,10,11)
InChIKey	InChI	1.03	SOGNHUJSAKAIRG-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	10442820

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