2-[4-(2-cyanoethylsulfanylmethyl)-1,3-thiazol-2-yl]guanidine; methanesulfonate

Systemtic Name: 2-[4-(2-cyanoethylsulfanylmethyl)-1,3-thiazol-2-yl]guanidine; methanesulfonate Openeye Name: 2-[4-(2-cyanoethylsulfanylmethyl)thiazol-2-yl]guanidine; methanesulfonate CAS Name: 2-[4-[(2-cyanoethylthio)methyl]-2-thiazolyl]guanidine; methanesulfonate IUPAC Name: 2-[4-(2-cyanoethylsulfanylmethyl)-1,3-thiazol-2-yl]guanidine; methanesulfonate Traditional Name: 2-[4-[(2-cyanoethylthio)methyl]thiazol-2-yl]guanidine mesylate Formula: C9H14N5O3S3- MolecularWeight: 336.43416

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=C(N=C(S1)N=C(N)N)CSCCC#N

Isomeric SMILES

CS(=O)(=O)[O-].C1=C(N=C(S1)N=C(N)N)CSCCC#N

InChI

InChI=1S/C8H11N5S2.CH4O3S/c9-2-1-3-14-4-6-5-15-8(12-6)13-7(10)11;1-5(2,3)4/h5H,1,3-4H2,(H4,10,11,12,13);1H3,(H,2,3,4)/p-1