Q7F

6-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-~{N}4-phenyl-1,3,5-triazine-2,4-diamine

Created:	2022-10-14
Last modified:	2023-02-01

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2 entries where Q7F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	44
Chiral Atom Count	0
Bond Count	46
Aromatic Bond Count	17

2D diagram of Q7F

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Chemical Component Summary
Name	6-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-~{N}4-phenyl-1,3,5-triazine-2,4-diamine
Systematic Name (OpenEye OEToolkits)	6-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-~{N}4-phenyl-1,3,5-triazine-2,4-diamine
Formula	C₁₇ H₂₀ N₆ S
Molecular Weight	340.446
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CN(Cc1sccc1C)Cc2nc(N)nc(Nc3ccccc3)n2
SMILES	OpenEye OEToolkits	3.1.0.0	Cc1ccsc1CN(C)Cc2nc(nc(n2)Nc3ccccc3)N
Canonical SMILES	CACTVS	3.385	CN(Cc1sccc1C)Cc2nc(N)nc(Nc3ccccc3)n2
Canonical SMILES	OpenEye OEToolkits	3.1.0.0	Cc1ccsc1CN(C)Cc2nc(nc(n2)Nc3ccccc3)N
InChI	InChI	1.06	InChI=1S/C17H20N6S/c1-12-8-9-24-14(12)10-23(2)11-15-20-16(18)22-17(21-15)19-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H3,18,19,20,21,22)
InChIKey	InChI	1.06	PJORKXLDJATLJK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	17449326

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