ethane-1,2-disulfonic acid; 4-methyl-5-propyl-1,3-thiazol-2-amine

Systemtic Name: ethane-1,2-disulfonic acid; 4-methyl-5-propyl-1,3-thiazol-2-amine Openeye Name: ethane-1,2-disulfonic acid; 4-methyl-5-propyl-thiazol-2-amine CAS Name: ethane-1,2-disulfonic acid; 4-methyl-5-propyl-2-thiazolamine IUPAC Name: ethane-1,2-disulfonic acid; 4-methyl-5-propyl-1,3-thiazol-2-amine Traditional Name: ethane-1,2-disulfonic acid; (4-methyl-5-propyl-thiazol-2-yl)amine Formula: C9H18N2O6S3 MolecularWeight: 346.44402

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)N)C.C(CS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCC1=C(N=C(S1)N)C.C(CS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C7H12N2S.C2H6O6S2/c1-3-4-6-5(2)9-7(8)10-6;3-9(4,5)1-2-10(6,7)8/h3-4H2,1-2H3,(H2,8,9);1-2H2,(H,3,4,5)(H,6,7,8)