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Home Other Building Blocks ({[4-(1H-pyrazol-1-yl)phenyl]methyl}sulfanyl)methanimidamide hydrochloride

({[4-(1H-pyrazol-1-yl)phenyl]methyl}sulfanyl)methanimidamide hydrochloride

CAS No.:
1909336-38-4
Catalog Number:
AG01C1GG
Molecular Formula:
C11H13ClN4S
Molecular Weight:
268.7657
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Product Description
Catalog Number:
AG01C1GG
Chemical Name:
({[4-(1H-pyrazol-1-yl)phenyl]methyl}sulfanyl)methanimidamide hydrochloride
CAS Number:
1909336-38-4
Molecular Formula:
C11H13ClN4S
Molecular Weight:
268.7657
MDL Number:
MFCD29047289
IUPAC Name:
(4-pyrazol-1-ylphenyl)methyl carbamimidothioate;hydrochloride
InChI:
InChI=1S/C11H12N4S.ClH/c12-11(13)16-8-9-2-4-10(5-3-9)15-7-1-6-14-15;/h1-7H,8H2,(H3,12,13);1H
InChI Key:
JEZFTDZUAHOOFT-UHFFFAOYSA-N
SMILES:
NC(=N)SCc1ccc(cc1)n1cccn1.Cl
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.055g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
268.763g/mol
Monoisotopic Mass:
268.055g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties