T2C

(2S)-1,3-thiazolidine-2-carboxylic acid

Created:	2019-09-25
Last modified:	2020-03-18

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1 entries where T2C is found as a standalone ligand2 entries where T2C is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	1
Bond Count	15
Aromatic Bond Count	0

2D diagram of T2C

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Chemical Component Summary
Name	(2S)-1,3-thiazolidine-2-carboxylic acid
Systematic Name (OpenEye OEToolkits)	(2~{S})-1,3-thiazolidine-2-carboxylic acid
Formula	C₄ H₇ N O₂ S
Molecular Weight	133.169
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	C1(C(O)=O)NCCS1
SMILES	CACTVS	3.385	OC(=O)[CH]1NCCS1
SMILES	OpenEye OEToolkits	2.0.7	C1CSC(N1)C(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)[C@H]1NCCS1
Canonical SMILES	OpenEye OEToolkits	2.0.7	C1CS[C@H](N1)C(=O)O
InChI	InChI	1.03	InChI=1S/C4H7NO2S/c6-4(7)3-5-1-2-8-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1
InChIKey	InChI	1.03	ULSZVNJBVJWEJE-VKHMYHEASA-N

Related Resource References

Resource Name	Reference
PubChem	6998902, 6998901
ChEMBL	CHEMBL3786701

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