106433-44-7
[3-[[[2-(DIAMINOMETHYLENEAMINO)-4-THIAZOLYL]METHYL]THIO]PROPIONYL]SULFAMIDE
Name[3-[[[2-(DIAMINOMETHYLENEAMINO)-4-THIAZOLYL]METHYL]THIO]PROPIONYL]SULFAMIDE
1Identification
【Name】
[3-[[[2-(DIAMINOMETHYLENEAMINO)-4-THIAZOLYL]METHYL]THIO]PROPIONYL]SULFAMIDE
【CAS】
【MDL】
MFCD03788838
【English Synonyms】
【Formula】
C8 H14 N6 O3 S3
【MolWeight】
338.436
【Inchi】
InChI=1S/C8H14N6O3S3/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)
【InChIKey】
InChIKey=BPCROVNHEMFQOD-UHFFFAOYSA-N
【SMILES】
c1c(nc(s1)N=C(N)N)CSCCC(=O)NS(=O)(=O)N
【MOL File】
[3-[[[2-(DIAMINOMETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:9
XLogP3:-6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[3-[[[2-(DIAMINOMETHYLENEAMINO)-4-THIAZOLYL]METHYL]THIO]PROPIONYL]SULFAMIDE.cml