SM19712   Click here for help

GtoPdb Ligand ID: 5272

Synonyms: SM-19712
Compound class: Synthetic organic
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES N#Cc1c(C)nn(c1NC(=O)NS(=O)(=O)c1ccc(cc1)Cl)c1ccccc1.[Na+]
Isomeric SMILES N#Cc1c(C)nn(c1NC(=O)NS(=O)(=O)c1ccc(cc1)Cl)c1ccccc1.[Na+]
InChI InChI=1S/C18H14ClN5O3S.Na/c1-12-16(11-20)17(24(22-12)14-5-3-2-4-6-14)21-18(25)23-28(26,27)15-9-7-13(19)8-10-15;/h2-10H,1H3,(H2,21,23,25);/q;+1
InChI Key XJBBHNFWWJTEGW-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
sodium 1-[(4-chlorobenzene)sulfonyl]-3-(4-cyano-3-methyl-1-phenyl-1H-pyrazol-5-yl)urea
Synonyms Click here for help
SM-19712
Database Links Click here for help
CAS Registry No. 194542-56-8
GtoPdb PubChem SID 178101955
PubChem CID 73755112
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