| CAS Number | 76824-17-4 |
| Catalog Number | AG00G550(AGN-PC-0NKAO2) |
| Chemical Name | Propanamide, 3-[[[2-[(aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-N-(aminosulfonyl)-, hydrochloride (1:1) |
| IUPAC Name | 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N-sulfamoylpropanamide;hydrochloride |
| InChI | InChI=1S/C8H14N6O3S3.ClH/c9-7(10)13-8-12-5(4-19-8)3-18-2-1-6(15)14-20(11,16)17;/h4H,1-3H2,(H,14,15)(H2,11,16,17)(H4,9,10,12,13);1H |
| InChI Key | LBBLJRHWJZWHQA-UHFFFAOYSA-N |
| MDL Number | MFCD27966020 |
| Molecular Formula | C8H15ClN6O3S3 |
| Molecular Weight | 374.8911 |
| SMILES | c1c(nc(s1)NC(=N)N)CSCCC(=O)NS(=O)(=O)N.Cl |
| Synonyms | 76824-17-4,
Famotidine Impurity C HCl,
Famotidine EP impurity C,
SCHEMBL11237738,
DTXSID70509959,
AKOS030530226,
[3-[[[2-(Diaminomethyleneamino)-4-thiazolyl]methyl]thio]propionyl]sulfamide Hydrochloride(Famotidine Impurity),
FT-0666379,
A1-06479,
[3-[[[2-(Diaminomethyleneamino)-4-thiazolyl]methyl]thio]propionyl]sulfamide Hydrochloride,
3-[({2-[(Diaminomethylidene)amino]-1,3-thiazol-4-yl}methyl)sulfanyl]-N-sulfamoylpropanamide--hydrogen chloride (1/1),
3-[[[2-[(Aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-N-(aminosulfonyl)propanamide Hydrochloride,
3-[[[2-[(Diaminomethylene)amino]thiazol-4-yl]methyl]sulfanyl]-N-sulfamoyl-propanamide Hydrochloride,
3-[[[2-[(Diaminomethylene)amino]thiazol-4-yl]methyl]sulfanyl]-N-sulfamoylpropanamide Hydrochloride,
3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N-sulfamoylpropanamide;hydrochloride,
LBBLJRHWJZWHQA-UHFFFAOYSA-N,
|
| Complexity | 459 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 374.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 374.877g/mol |
| Monoisotopic Mass | 374.006g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 229A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number