[4-[[(7,7-dioxo-7λ6-thia-8-azabicyclo[4.3.0]nona-1,3,5,8-tetraen-9-yl)-(4-methylphenyl)amino]methyl]-2-methoxy-phenyl] 2-bromobenzoate
Molecular Formula:
C
29
H
23
BrN
2
O
5
S
InChI:
InChI=1/C29H23BrN2O5S/c1-19-11-14-21(15-12-19)32(28-23-8-4-6-10-27(23)38(34,35)31-28)18-20-13-16-25(26(17-20)36-2)37-29(33)22-7-3-5-9-24(22)30/h3-17H,18H2,1-2H3
InChIKey:
InChIKey=OCCBBFFJSUFDHO-UHFFFAOYAT
SMILES:
CC1=CC=C(C=C1)N(CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3Br)OC)C4=NS(=O)(=O)C5=CC=CC=C54
Names:
[4-[[(7,7-dioxo-7λ6-thia-8-azabicyclo[4.3.0]nona-1,3,5,8-tetraen-9-yl)-(4-methylphenyl)amino]methyl]-2-methoxy-phenyl] 2-bromobenzoate
Registries:
PubChem CID 1811125
PubChem ID 6007055