Vitas-M small molecule compound
2-{(Z)-[2-(4-ethylpiperazin-4-ium-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenolate
Catalog ID
STL048059
SMILES CC[NH+]1CCN(CC1)C1=NC(=O)/C(=C/c2ccccc2[O-])/S1
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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 C16H19N3O2S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O2S/c1-2-18-7-9-19(10-8-18)16-17-15(21)14(22-16)11-12-5-3-4-6-13(12)20/h3-6,11,20H,2,7-10H2,1H3/b14-11-InChIKey
MXVGPIGMEBUHIA-KAMYIIQDSA-NSynonyms
444801-65-4(5Z)2(4ETHYLPIPERAZIN1YL)5((2HYDROXYPHENYL)METHYLIDENE)13THIAZOL4ONE
2((Z)(2(4ethylpiperazin4ium1yl)4oxo13thiazol5(4H)ylidene)methyl)phenolate
444801654
CC(NH+)1CCN(CC1)C1=NC(=O)C(=Cc2ccccc2(O))S1
CCN1CCN(CC1)C2=NC(=O)C(=CC3=CC=CC=C3O)S2
InChI=1SC16H19N3O2Sc12187919(10818)161715(21)14(2216)1112534613(12)20h361120H2710H21H3b1411
MFCD04029330
ZINC000019841929
ZINC19841929
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