AG0059IM

76823-93-3 | Guanidine,[4-[[(2-cyanoethyl)thio]methyl]-2-thiazolyl]- (9CI)

AG0059IM

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CAS Number	76823-93-3
Catalog Number	AG0059IM(AGN-PC-0OHVZ2)
Chemical Name	Guanidine,[4-[[(2-cyanoethyl)thio]methyl]-2-thiazolyl]- (9CI)
IUPAC Name	2-[4-(2-cyanoethylsulfanylmethyl)-1,3-thiazol-2-yl]guanidine
InChI	InChI=1S/C8H11N5S2/c9-2-1-3-14-4-6-5-15-8(12-6)13-7(10)11/h5H,1,3-4H2,(H4,10,11,12,13)
InChI Key	FSKYYRZENXOYAP-UHFFFAOYSA-N
MDL Number	MFCD07369306
Molecular Formula	C8H11N5S2
Molecular Weight	241.3364
SMILES	C(#N)CCSCC=1N=C(SC1)NC(=N)N
Synonyms	76823-93-3, 2-[4-(2-Cyanoethylthio)methyl]thiazolyl guanidine, 3-(2-GUANIDINO-THIAZOL-4-YL-METHYLTHIO)-PROPIONITRILE, 3-(2-(diaminomethyleneamino)thiazol-4-yl)methylthio)propiononitrile, Guanidine, (4-(((2-cyanoethyl)thio)methyl)-2-thiazolyl)-, 3-(2-guanidinothiazol-4-ylmethylthio)propanitrile, 2-[4-(2-cyanoethylsulfanylmethyl)-1,3-thiazol-2-yl]guanidine, 3-[[[2-[(Diaminomethylene]amino-4-thiazolyl]thio]propionitrile, C8H11N5S2, AC1NNQ3M, EC 403-710-2, N-[4-(cyanoethylthiomethyl)-2-thiazolyl]guanidine, SCHEMBL8699933, DTXSID90227643, FSKYYRZENXOYAP-UHFFFAOYSA-N, ZINC5019144, AKOS015898575, MCULE-2080940783, VZ23429, AN-36828, R865, FT-0641616, ST50983990, 3-(2-Guanidino-4-thiazolylmethylthio)propionitrile, 3-(2-guanidinothiazol-4-ylmethylthio)propionitrile, 823C933, A838848, I09-3182, 2-[4-(2-Cyanoethylthiomethyl)thiazol-2-yl]guanidine, [4-[[(2-Cyanoethyl)thio]methyl]-2-thiazolyl]guanidine, 2-(4-((2-cyanoethylthio)methyl)thiazol-2-yl)guanidine, 2-[4-(2-cyanoethylsulfanylmethyl)thiazol-2-yl]guanidine, 2-[4-(2-Cyanoethylthio)methyl]thiazolyl guanidine, 97%, 2-[4-[(2-cyanoethylthio)methyl]-2-thiazolyl]guanidine, 1-(4-(((2-cyanoethyl)thio)methyl)thiazol-2-yl)guanidine, N"-[4-[[(2-cyanoethyl)thio]methyl]-2-thiazolyl]guanidine, N"-[4[[(2-cyanoethyl)thio]methyl]-2-thiazolyl]-guanidine, N-(4-((2-Cyanoethyl)Thio)Methyl)-2-Thiazolyl)Guanidine, 3-{[2-(2,2-diamino-1-azavinyl)-1,3-thiazol-4-yl]methylthio}propanenitrile, C8-H11-N5-S2, CID5075259, Guanidine, [4-[[(2-cyanoethyl)thio]methyl]-2-thiazolyl]-, TPN,

Complexity	268
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.046g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	241.331g/mol
Monoisotopic Mass	241.046g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	155A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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