3-Oxo ziprasidone[3-氧代齐拉西酮]

CAS:1159977-56-6

SKU: NCC.1159977.56.6 分类:
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CAS Registry Number®

1159977-56-6

CAS Name

5-[2-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-1H-indole-2,3-dione

Molecular Formula

C21H19ClN4O2S

Molecular Mass

426.92

Other Names and Identifiers

InChI

InChI=1S/C21H19ClN4O2S/c22-16-12-17-15(19(27)21(28)23-17)11-13(16)5-6-25-7-9-26(10-8-25)20-14-3-1-2-4-18(14)29-24-20/h1-4,11-12H,5-10H2,(H,23,27,28)

InChIKey

InChIKey=VWHQRPYTDLERQO-UHFFFAOYSA-N

SMILES

C(CC=1C=C2C(=CC1Cl)NC(=O)C2=O)N3CCN(C=4C=5C(SN4)=CC=CC5)CC3

Canonical SMILES

O=C1NC2=CC(Cl)=C(C=C2C1=O)CCN3CCN(C4=NSC=5C=CC=CC54)CC3

Other Names for this Substance

  • 1H-Indole-2,3-dione, 5-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-
  • 5-[2-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-1H-indole-2,3-dione
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