Vitas-M small molecule compound
4-(isoquinolinium-2-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Catalog ID
STK528016
SMILES O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1)[n+]1ccc2c(c1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H14N4O2S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O2S/c25-19(15-7-2-1-3-8-15)23-21-12-17-18(22-20(26)27-17)24-11-10-14-6-4-5-9-16(14)13-24/h1-13H,(H-,21,22,23,25,26)InChIKey
ZYORMRBBKNMWHI-UHFFFAOYSA-NSynonyms
370072-21-2(E)5((2benzoylhydrazono)methyl)4(isoquinolin2ium2yl)2oxothiazol3ide
370072212
4(isoquinolinium2yl)2oxo5((E)(2(phenylcarbonyl)hydrazinylidene)methyl)13thiazol3ide
4ISOQUINOLIN2IUM2YL5((PHENYLCARBONYLHYDRAZINYLIDENE)METHYL)13THIAZOL2OLATE
5((BENZOYLHYDRAZINYLIDENE)METHYL)4(2ISOQUINOLIN2IUMYL)2THIAZOLOLATE
5((BENZOYLHYDRAZINYLIDENE)METHYL)4ISOQUINOLIN2IUM2YL13THIAZOL2OLATE
5((BENZOYLHYDRAZONO)METHYL)4ISOQUINOLIN2IUM2YLTHIAZOL2OLATE
5((Z)(BENZOYLHYDRAZINYLIDENE)METHYL)4ISOQUINOLIN2IUM2YL13THIAZOL2OLATE
C1=CC=C(C=C1)C(=O)NN=CC2=C(N=C(S2)(O))(N+)3=CC4=CC=CC=C4C=C3
InChI=1SC20H14N4O2Sc2519(157213815)2321121718(2220(26)2717)24111014645916(14)1324h113H(H2122232526)
MFCD01176653
O=c1(n)c(c(s1)C=NNC(=O)c1ccccc1)(n+)1ccc2c(c1)cccc2
ZINC000015895141
ZINC13755992
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.