3-ethyl-2,6-dimethyl-benzothiazole; 4-methylbenzenesulfonate
Molecular Formula:
C
18
H
21
NO
3
S
2
InChI:
InChI=1/C11H14NS.C7H8O3S/c1-4-12-9(3)13-11-7-8(2)5-6-10(11)12;1-6-2-4-7(5-3-6)11(8,9)10/h5-7H,4H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/fC11H14NS.C7H7O3S/qm;-1
InChIKey:
InChIKey=RFULESNLBGVLQP-QPAIYEIACX
SMILES:
CC[N+]1=C(SC2=C1C=CC(=C2)C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]
Names:
3-ethyl-2,6-dimethyl-benzothiazole; 4-methylbenzenesulfonate
Registries:
PubChem CID 2827563
PubChem ID 3290420