G0I

1-[4-ethyl-2-methyl-5-[2-(piperazin-1-ylmethyl)-1,3-thiazol-4-yl]-1~{H}-pyrrol-3-yl]ethanone

Created:	2022-01-26
Last modified:	2022-09-28

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1 entries where G0I is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	47
Chiral Atom Count	0
Bond Count	49
Aromatic Bond Count	10

2D diagram of G0I

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Chemical Component Summary
Name	1-[4-ethyl-2-methyl-5-[2-(piperazin-1-ylmethyl)-1,3-thiazol-4-yl]-1~{H}-pyrrol-3-yl]ethanone
Systematic Name (OpenEye OEToolkits)	1-[4-ethyl-2-methyl-5-[2-(piperazin-1-ylmethyl)-1,3-thiazol-4-yl]-1~{H}-pyrrol-3-yl]ethanone
Formula	C₁₇ H₂₄ N₄ O S
Molecular Weight	332.464
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCc1c([nH]c(C)c1C(C)=O)c2csc(CN3CCNCC3)n2
SMILES	OpenEye OEToolkits	2.0.7	CCc1c(c([nH]c1c2csc(n2)CN3CCNCC3)C)C(=O)C
Canonical SMILES	CACTVS	3.385	CCc1c([nH]c(C)c1C(C)=O)c2csc(CN3CCNCC3)n2
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCc1c(c([nH]c1c2csc(n2)CN3CCNCC3)C)C(=O)C
InChI	InChI	1.06	InChI=1S/C17H24N4OS/c1-4-13-16(12(3)22)11(2)19-17(13)14-10-23-15(20-14)9-21-7-5-18-6-8-21/h10,18-19H,4-9H2,1-3H3
InChIKey	InChI	1.06	CWHYBFBVUSCTHI-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	139018625

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