2-[3-(2-azanylethylsulfanylmethyl)-1,2,4-thiadiazol-5-yl]guanidine; ethanedioic acid

Systemtic Name: 2-[3-(2-azanylethylsulfanylmethyl)-1,2,4-thiadiazol-5-yl]guanidine; ethanedioic acid Openeye Name: 2-[3-(2-aminoethylsulfanylmethyl)-1,2,4-thiadiazol-5-yl]guanidine; oxalic acid CAS Name: 2-[3-[(2-aminoethylthio)methyl]-1,2,4-thiadiazol-5-yl]guanidine; oxalic acid IUPAC Name: 2-[3-(2-aminoethylsulfanylmethyl)-1,2,4-thiadiazol-5-yl]guanidine; oxalic acid Traditional Name: 2-[3-[(2-aminoethylthio)methyl]-1,2,4-thiadiazol-5-yl]guanidine; oxalic acid Formula: C8H14N6O4S2 MolecularWeight: 322.36456

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Descriptors Computed from Structure

Canonical SMILES:

C(CSCC1=NSC(=N1)N=C(N)N)N.C(=O)(C(=O)O)O

Isomeric SMILES

C(CSCC1=NSC(=N1)N=C(N)N)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C6H12N6S2.C2H2O4/c7-1-2-13-3-4-10-6(14-12-4)11-5(8)9;3-1(4)2(5)6/h1-3,7H2,(H4,8,9,10,11,12);(H,3,4)(H,5,6)