6T6

(2R)-2-methyl-5-phenyl-2-(3-pyridin-3-ylphenyl)-2,3-dihydro-1H-imidazol-4-amine

Created:	2012-07-10
Last modified:	2014-09-05

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1 entries where 6T6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	45
Chiral Atom Count	1
Bond Count	48
Aromatic Bond Count	18

2D diagram of 6T6

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Chemical Component Summary
Name	(2R)-2-methyl-5-phenyl-2-(3-pyridin-3-ylphenyl)-2,3-dihydro-1H-imidazol-4-amine
Systematic Name (OpenEye OEToolkits)	(2R)-2-methyl-5-phenyl-2-(3-pyridin-3-ylphenyl)-1,3-dihydroimidazol-4-amine
Formula	C₂₁ H₂₀ N₄
Molecular Weight	328.41
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	n4cccc(c1cc(ccc1)C2(NC(=C(N)N2)c3ccccc3)C)c4
SMILES	CACTVS	3.385	C[C]1(NC(=C(N1)c2ccccc2)N)c3cccc(c3)c4cccnc4
SMILES	OpenEye OEToolkits	1.9.2	CC1(NC(=C(N1)N)c2ccccc2)c3cccc(c3)c4cccnc4
Canonical SMILES	CACTVS	3.385	C[C@@]1(NC(=C(N1)c2ccccc2)N)c3cccc(c3)c4cccnc4
Canonical SMILES	OpenEye OEToolkits	1.9.2	C[C@]1(NC(=C(N1)N)c2ccccc2)c3cccc(c3)c4cccnc4
InChI	InChI	1.03	InChI=1S/C21H20N4/c1-21(24-19(20(22)25-21)15-7-3-2-4-8-15)18-11-5-9-16(13-18)17-10-6-12-23-14-17/h2-14,24-25H,22H2,1H3/t21-/m1/s1
InChIKey	InChI	1.03	BLSGQDNQCUBPGO-OAQYLSRUSA-N

Related Resource References

Resource Name	Reference
PubChem	60202319

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