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Details

Stereochemistry ACHIRAL
Molecular Formula 2C17H16N6O.2CH4O3S.H2O
Molecular Weight 850.924
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZONIPORIDE MESYLATE HEMIHYDRATE

SMILES

O.CS(O)(=O)=O.CS(O)(=O)=O.NC(=N)NC(=O)C1=C(C2CC2)N(N=C1)C3=CC=CC4=NC=CC=C34.NC(=N)NC(=O)C5=C(C6CC6)N(N=C5)C7=CC=CC8=NC=CC=C78

InChI

InChIKey=HGNAEEHUNCEYEO-UHFFFAOYSA-N
InChI=1S/2C17H16N6O.2CH4O3S.H2O/c2*18-17(19)22-16(24)12-9-21-23(15(12)10-6-7-10)14-5-1-4-13-11(14)3-2-8-20-13;2*1-5(2,3)4;/h2*1-5,8-10H,6-7H2,(H4,18,19,22,24);2*1H3,(H,2,3,4);1H2

HIDE SMILES / InChI

Approval Year

Name Type Language
ZONIPORIDE MESYLATE HEMIHYDRATE
Common Name English
1H-PYRAZOLE-4-CARBOXAMIDE, N-(AMINOIMINOMETHYL)-5-CYCLOPROPYL-1-(5-QUINOLINYL)-, METHANESULFONATE, HYDRATE (2:2:1)
Common Name English
Code System Code Type Description
PUBCHEM
71300877
Created by admin on Sat Dec 16 01:22:51 UTC 2023 , Edited by admin on Sat Dec 16 01:22:51 UTC 2023
PRIMARY
FDA UNII
FW861BH5NA
Created by admin on Sat Dec 16 01:22:51 UTC 2023 , Edited by admin on Sat Dec 16 01:22:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID20187367
Created by admin on Sat Dec 16 01:22:51 UTC 2023 , Edited by admin on Sat Dec 16 01:22:51 UTC 2023
PRIMARY
CAS
336881-22-2
Created by admin on Sat Dec 16 01:22:51 UTC 2023 , Edited by admin on Sat Dec 16 01:22:51 UTC 2023
PRIMARY