Vitas-M small molecule compound

4-(3,4-dimethylpyridinium-1-yl)-5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3-ide

Catalog ID
STK527803
SMILES O=c1sc(c([n-]1)[n+]1ccc(c(c1)C)C)/C=N/NC(=O)c1ccccc1O

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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 C18H16N4O3S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3S/c1-11-7-8-22(10-12(11)2)16-15(26-18(25)20-16)9-19-21-17(24)13-5-3-4-6-14(13)23/h3-10H,1-2H3,(H2-,19,20,21,23,24,25)
InChIKey
CFNMAVLTANNOAS-UHFFFAOYSA-N
Synonyms
459790-14-8
(E)4(34dimethylpyridin1ium1yl)5((2(2hydroxybenzoyl)hydrazono)methyl)2oxothiazol3ide
2((((E)(4(34dimethylpyridin1ium1yl)2oxo13thiazol5ylidene)methyl)amino)carbamoyl)phenolate
2(((4(34DIMETHYLPYRIDIN1IUM1YL)2OXO13THIAZOL5YLIDENE)METHYLAMINO)CARBAMOYL)PHENOLATE
4(34dimethylpyridinium1yl)5((E)(2((2hydroxyphenyl)carbonyl)hydrazinylidene)methyl)2oxo13thiazol3ide
459790148
CC1=C(C=(N+)(C=C1)C2=NC(=O)SC2=CNNC(=O)C3=CC=CC=C3(O))C
InChI=1SC18H16N4O3Sc1117822(1012(11)2)1615(2618(25)2016)9192117(24)13534614(13)23h310H12H3(H2192021232425)
MFCD00785092
O=c1sc(c((n)1)(n+)1ccc(c(c1)C)C)C=NNC(=O)c1ccccc1O
ZINC000015973852
ZINC13496591

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Available files

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