Catalog Number:
AG0004DH
Chemical Name:
2H,7H-[1,4]Dioxepino[2,3-g]-1,2,4-benzothiadiazin-3(4H)-one, 8,9-dihydro-2-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-, 1,1-dioxide
CAS Number:
101389-34-8
Molecular Formula:
C23H28N4O6S
Molecular Weight:
488.5566
IUPAC Name:
2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,1-dioxo-4,7,8,9-tetrahydro-[1,4]dioxepino[2,3-g][1,2,4]benzothiadiazin-3-one
InChI:
InChI=1S/C23H28N4O6S/c1-31-19-6-3-2-5-18(19)26-10-7-25(8-11-26)9-12-27-23(28)24-17-15-20-21(33-14-4-13-32-20)16-22(17)34(27,29)30/h2-3,5-6,15-16H,4,7-14H2,1H3,(H,24,28)
InChI Key:
XKOFWTSBRWQMHU-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCN(CC1)CCN1C(=O)Nc2c(S1(=O)=O)cc1c(c2)OCCCO1