GH1

(5S)-5-({4-[2-(3-methoxyphenyl)-2-oxoethoxy]phenyl}methyl)-1,3-thiazolidine-2,4-dione

Created:	2018-05-21
Last modified:	2019-05-22

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1 entries where GH1 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	43
Chiral Atom Count	1
Bond Count	45
Aromatic Bond Count	12

2D diagram of GH1

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Chemical Component Summary
Name	(5S)-5-({4-[2-(3-methoxyphenyl)-2-oxoethoxy]phenyl}methyl)-1,3-thiazolidine-2,4-dione
Systematic Name (OpenEye OEToolkits)	5-[[4-[2-(3-methoxyphenyl)-2-oxidanylidene-ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Formula	C₁₉ H₁₇ N O₅ S
Molecular Weight	371.407
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(ccc(cc1)CC2C(NC(=O)S2)=O)OCC(c3cccc(OC)c3)=O
SMILES	CACTVS	3.385	COc1cccc(c1)C(=O)COc2ccc(C[CH]3SC(=O)NC3=O)cc2
SMILES	OpenEye OEToolkits	2.0.6	COc1cccc(c1)C(=O)COc2ccc(cc2)CC3C(=O)NC(=O)S3
Canonical SMILES	CACTVS	3.385	COc1cccc(c1)C(=O)COc2ccc(C[C@@H]3SC(=O)NC3=O)cc2
Canonical SMILES	OpenEye OEToolkits	2.0.6	COc1cccc(c1)C(=O)COc2ccc(cc2)CC3C(=O)NC(=O)S3
InChI	InChI	1.03	InChI=1S/C19H17NO5S/c1-24-15-4-2-3-13(10-15)16(21)11-25-14-7-5-12(6-8-14)9-17-18(22)20-19(23)26-17/h2-8,10,17H,9,11H2,1H3,(H,20,22,23)/t17-/m0/s1
InChIKey	InChI	1.03	YAUMOGALQJYOJQ-KRWDZBQOSA-N

Related Resource References

Resource Name	Reference
PubChem	76964215

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