5-benzyl-1-(2-methylpropyl)-1,3-diaza-5-azoniacyclohexane-2-thione
Molecular Formula:
C
14
H
22
N
3
S
+
InChI:
InChI=1/C14H21N3S/c1-12(2)8-17-11-16(10-15-14(17)18)9-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,15,18)/p+1/fC14H22N3S/h15-16H/q+1
InChIKey:
InChIKey=OTCIMHQAJPECAO-BCWVLUKTCZ
SMILES:
CC(C)CN1C[NH+](CNC1=S)CC2=CC=CC=C2
Names:
5-benzyl-1-(2-methylpropyl)-1,3-diaza-5-azoniacyclohexane-2-thione
Registries:
PubChem CID 3546584
PubChem ID 4793151