ZINC06410770
Molecular Formula:
C
18
H
13
BrNO
3
S
-
InChI:
InChI=1/C18H14BrNO3S/c1-23-15-7-6-13(19)9-11(15)8-12(10-17(21)22)18-20-14-4-2-3-5-16(14)24-18/h2-9H,10H2,1H3,(H,21,22)/p-1/b12-8+/fC18H13BrNO3S/q-1
InChIKey:
InChIKey=RTRDMVZQSQPZST-VJQBMKDIDV
SMILES:
COC1=C(C=C(C=C1)Br)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3S2
Names:
ZINC06410770
(E)-3-benzothiazol-2-yl-4-(5-bromo-2-methoxy-phenyl)but-3-enoate
Registries:
PubChem CID 7967168
PubChem ID 13285236