HCQ

[5-(aminomethyl)-1-benzothiophen-2-yl]-tris(oxidanyl)boranuide

Created:	2018-12-03
Last modified:	2019-04-24

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1 entries where HCQ is found as a standalone ligand

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Chemical Details
Formal Charge	-1
Atom Count	26
Chiral Atom Count	0
Bond Count	27
Aromatic Bond Count	10

2D diagram of HCQ

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Chemical Component Summary
Name	[5-(aminomethyl)-1-benzothiophen-2-yl]-tris(oxidanyl)boranuide
Systematic Name (OpenEye OEToolkits)	[5-(aminomethyl)-1-benzothiophen-2-yl]-tris(oxidanyl)boranuide
Formula	C₉ H₁₁ B N O₃ S
Molecular Weight	224.065
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	NCc1ccc2sc(cc2c1)[B-](O)(O)O
SMILES	OpenEye OEToolkits	2.0.6	[B-](c1cc2cc(ccc2s1)CN)(O)(O)O
Canonical SMILES	CACTVS	3.385	NCc1ccc2sc(cc2c1)[B-](O)(O)O
Canonical SMILES	OpenEye OEToolkits	2.0.6	[B-](c1cc2cc(ccc2s1)CN)(O)(O)O
InChI	InChI	1.03	InChI=1S/C9H11BNO3S/c11-5-6-1-2-8-7(3-6)4-9(15-8)10(12,13)14/h1-4,12-14H,5,11H2/q-1
InChIKey	InChI	1.03	MOEIXULQWWCKOY-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	137797036

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