5-[(5-Amino-1,3,4-thiadiazol-2-yl)methyl]-1,3,4-thiadiazol-2-ylamine Oxalate - CAS 1177328-21-0
Catalog: |
BB074469 |
Product Name: |
5-[(5-Amino-1,3,4-thiadiazol-2-yl)methyl]-1,3,4-thiadiazol-2-ylamine Oxalate |
CAS: |
1177328-21-0 |
Synonyms: |
5-[(5-AMINO-1,3,4-THIADIAZOL-2-YL)METHYL]-1,3,4-THIADIAZOL-2-YLAMINE OXALATE; 5-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3,4-thiadiazol-2-amine; oxalic acid; 5,5'-Methanediylbis(1,3,4-thiadiazol-2-amine) (C2H2O4); 5-[(5-AMINO-1,3,4-THIADIAZOL-2-YL)METHYL]-1,3,4-THIADIAZOL-2-YLAMINEOXALATE |
IUPAC Name: | 5-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3,4-thiadiazol-2-amineoxalic acid |
Description: | 5-[(5-Amino-1,3,4-thiadiazol-2-yl)methyl]-1,3,4-thiadiazol-2-ylamine Oxalate |
Molecular Weight: | 214.27 + (90.03) |
Molecular Formula: | C5H6N6S2·C2H2O4 |
Canonical SMILES: | C(C1=NN=C(S1)N)C2=NN=C(S2)N.C(=O)(C(=O)O)O |
InChI: | InChI=1S/C5H6N6S2.C2H2O4/c6-4-10-8-2(12-4)1-3-9-11-5(7)13-33-1(4)2(5)6/h1H2,(H2,6,10)(H2,7,11)(H,3,4)(H,5,6) |
InChI Key: | WUZGNXKXUMSSIW-UHFFFAOYSA-N |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 304.0048451 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 12 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 304.0048451 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 235Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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