MST

2-T-BUTYLAMINO-4-ETHYLAMINO-6-METHYLTHIO-S-TRIAZINE

Created:	2000-01-17
Last modified:	2011-06-04

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4 entries where MST is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	6

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Chemical Component Summary
Name	2-T-BUTYLAMINO-4-ETHYLAMINO-6-METHYLTHIO-S-TRIAZINE
Systematic Name (OpenEye OEToolkits)	N-tert-butyl-N'-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine
Formula	C₁₀ H₁₉ N₅ S
Molecular Weight	241.356
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	S(c1nc(nc(n1)NC(C)(C)C)NCC)C
SMILES	CACTVS	3.341	CCNc1nc(NC(C)(C)C)nc(SC)n1
SMILES	OpenEye OEToolkits	1.5.0	CCNc1nc(nc(n1)SC)NC(C)(C)C
Canonical SMILES	CACTVS	3.341	CCNc1nc(NC(C)(C)C)nc(SC)n1
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCNc1nc(nc(n1)SC)NC(C)(C)C
InChI	InChI	1.03	InChI=1S/C10H19N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)
InChIKey	InChI	1.03	IROINLKCQGIITA-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08215
Name	Terbutryn
Groups	experimental
Synonyms	Terbutryn Terbutryne
Categories	Agrochemicals Compounds used in a research, industrial, or household setting Herbicides Pesticides Toxic Actions
CAS number	886-50-0

Drug Targets

Name	Target Sequence	Pharmacological Action
Photosynthetic reaction center cytochrome c subunit	MKQLIVNSVATVALASLVAGCFEPPPATTTQTGFRGLSMGEVLHPATVKA...	unknown
Reaction center protein H chain	MYHGALAQHLDIAQLVWYAQWLVIWTVVLLYLRREDRREGYPLVEPLGLV...	unknown
Reaction center protein L chain	MALLSFERKYRVRGGTLIGGDLFDFWVGPYFVGFFGVSAIFFIFLGVSLI...	unknown
Reaction center protein M chain	MADYQTIYTQIQARGPHITVSGEWGDNDRVGKPFYSYWLGKIGDAQIGPI...	unknown
Reaction center protein L chain	MALLSFERKYRVPGGTLVGGNLFDFWVGPFYVGFFGVATFFFAALGIILI...	unknown
Reaction center protein M chain	MAEYQNIFSQVQVRGPADLGMTEDVNLANRSGVGPFSTLLGWFGNAQLGP...	unknown
Reaction center protein H chain	MVGVTAFGNFDLASLAIYSFWIFLAGLIYYLQTENMREGYPLENEDGTPA...	unknown
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682