ZINC07665275
Molecular Formula:
C
16
H
19
BrN
2
O
3
S
InChI:
InChI=1/C16H19BrN2O3S/c1-3-7-19-16(18)23-9-12-11-8-10(17)5-6-13(11)22-14(12)15(20)21-4-2/h5-6,8H,3-4,7,9H2,1-2H3,(H2,18,19)/f/h18H2/b19-16+
InChIKey:
InChIKey=HWCAAONGAGRMKK-HHRFBQFJDW
SMILES:
CCCN=C(N)SCC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCC
Names:
ethyl 5-bromo-3-[(N'-propylcarbamimidoyl)sulfanylmethyl]benzofuran-2-carboxylate
ZINC07665275
Registries:
PubChem CID 8775373
PubChem ID 14034545