Vitas-M small molecule compound
N-{2-[(2E)-2-{[5-iodo-2-(methylsulfanyl)thiophen-3-yl]methylidene}hydrazinyl]-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl}benzamide
Catalog ID
STK675106
SMILES CSc1sc(cc1/C=N/NC(=O)C(c1n[nH]c(=O)c2c1cccc2)NC(=O)c1ccccc1)I
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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 C23H18IN5O3S2 MW 603.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18IN5O3S2/c1-33-23-14(11-17(24)34-23)12-25-28-22(32)19(26-20(30)13-7-3-2-4-8-13)18-15-9-5-6-10-16(15)21(31)29-27-18/h2-12,19H,1H3,(H,26,30)(H,28,32)(H,29,31)/b25-12+InChIKey
GXQAARSVOHFCHC-BRJLIKDPSA-NSynonyms
CSC1=C(C=C(S1)I)C=NNC(=O)C(C2=NNC(=O)C3=CC=CC=C32)NC(=O)C4=CC=CC=C4
CSc1sc(cc1C=NNC(=O)C(c1n(nH)c(=O)c2c1cccc2)NC(=O)c1ccccc1)I
InChI=1SC23H18IN5O3S2c1332314(1117(24)3423)12252822(32)19(2620(30)137324813)18159561016(15)21(31)292718h21219H1H3(H2630)(H2832)(H2931)b2512+
MFCD01198985
N(2((2E)2((5iodo2(methylsulfanyl)thiophen3yl)methylidene)hydrazinyl)2oxo1(4oxo34dihydrophthalazin1yl)ethyl)benzamide
N(2((2E)2((5iodo2methylsulfanylthiophen3yl)methylidene)hydrazinyl)2oxo1(4oxo3Hphthalazin1yl)ethyl)benzamide
ZINC000100075168
ZINC000100075172
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