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89465-63-4 | 4-[(ethylcarbamoyl)amino]-1,2,5-thiadiazole-3-carboxamide
CAS No: 89465-63-4 Catalog No: AG0042AL MDL No:
Product Description
Catalog Number:
AG0042AL
Chemical Name:
4-[(ethylcarbamoyl)amino]-1,2,5-thiadiazole-3-carboxamide
CAS Number:
89465-63-4
Molecular Formula:
C6H9N5O2S
Molecular Weight:
215.2330
IUPAC Name:
4-(ethylcarbamoylamino)-1,2,5-thiadiazole-3-carboxamide
InChI:
InChI=1S/C6H9N5O2S/c1-2-8-6(13)9-5-3(4(7)12)10-14-11-5/h2H2,1H3,(H2,7,12)(H2,8,9,11,13)
InChI Key:
XUBDIUNIULKZHE-UHFFFAOYSA-N
SMILES:
CCNC(=O)Nc1nsnc1C(=O)N
NSC Number:
87989
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
215.231g/mol
Monoisotopic Mass:
215.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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