CAFFEINE, 8-((2-(DIETHYLAMINO)ETHYL)THIO)-, HYDROCHLORIDE
Molecular Formula:
C
14
H
24
ClN
5
O
2
S
InChI:
InChI=1/C14H23N5O2S.ClH/c1-6-19(7-2)8-9-22-13-15-11-10(16(13)3)12(20)18(5)14(21)17(11)4;/h6-9H2,1-5H3;1H/fC14H24N5O2S.Cl/h19H;1h/q+1;-1
InChIKey:
InChIKey=SGGGWDPUZQBKOH-INSCRCJLCU
SMILES:
CC[NH+](CC)CCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C.[Cl-]
Names:
CAFFEINE, 8-((2-(DIETHYLAMINO)ETHYL)THIO)-, HYDROCHLORIDE
diethyl-[2-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanylethyl]azanium chloride
24851-38-5
8-((2-(Diethylamino)ethyl)thio)caffeine hydrochloride
Registries:
PubChem CID 32715
PubChem ID 174638