LTK

~{N}-[3-(aminomethyl)phenyl]-5-chloranyl-3-methyl-1-benzothiophene-2-sulfonamide

Created:	2019-09-04
Last modified:	2020-04-22

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1 entries where LTK is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	38
Chiral Atom Count	0
Bond Count	40
Aromatic Bond Count	16

2D diagram of LTK

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Chemical Component Summary
Name	~{N}-[3-(aminomethyl)phenyl]-5-chloranyl-3-methyl-1-benzothiophene-2-sulfonamide
Systematic Name (OpenEye OEToolkits)	~{N}-[3-(aminomethyl)phenyl]-5-chloranyl-3-methyl-1-benzothiophene-2-sulfonamide
Formula	C₁₆ H₁₅ Cl N₂ O₂ S₂
Molecular Weight	366.886
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1c2cc(Cl)ccc2sc1[S](=O)(=O)Nc3cccc(CN)c3
SMILES	OpenEye OEToolkits	2.0.7	Cc1c2cc(ccc2sc1S(=O)(=O)Nc3cccc(c3)CN)Cl
Canonical SMILES	CACTVS	3.385	Cc1c2cc(Cl)ccc2sc1[S](=O)(=O)Nc3cccc(CN)c3
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1c2cc(ccc2sc1S(=O)(=O)Nc3cccc(c3)CN)Cl
InChI	InChI	1.03	InChI=1S/C16H15ClN2O2S2/c1-10-14-8-12(17)5-6-15(14)22-16(10)23(20,21)19-13-4-2-3-11(7-13)9-18/h2-8,19H,9,18H2,1H3
InChIKey	InChI	1.03	OMVVAHZLDYMIPY-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	146020572

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