Quetiapine Hydroxy Impurity[喹硫平羟基杂质]

329216-67-3

CAS Name

4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazineethanol

Molecular Formula

C₁₉H₂₁N₃OS

Molecular Mass

339.45

Other Names and Identifiers

InChI

InChI=1S/C19H21N3OS/c23-14-13-21-9-11-22(12-10-21)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)20-19/h1-8,23H,9-14H2

InChIKey

InChIKey=OFLMIXVKBNAUIB-UHFFFAOYSA-N

SMILES

C(CO)N1CCN(C=2C=3C(SC=4C(N2)=CC=CC4)=CC=CC3)CC1

Canonical SMILES

OCCN1CCN(C2=NC=3C=CC=CC3SC=4C=CC=CC42)CC1

Other Names for this Substance