Vitas-M small molecule compound
ethyl 5-benzyl-2-({[2-(pyridin-2-ylcarbonyl)hydrazinyl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK437152
SMILES CCOC(=O)c1cc(sc1NC(=S)NNC(=O)c1ccccn1)Cc1ccccc1
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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 C21H20N4O3S2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S2/c1-2-28-20(27)16-13-15(12-14-8-4-3-5-9-14)30-19(16)23-21(29)25-24-18(26)17-10-6-7-11-22-17/h3-11,13H,2,12H2,1H3,(H,24,26)(H2,23,25,29)InChIKey
PDXXWHJGJBKZMX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=O)C3=CC=CC=N3
ETHYL5BENZYL2((((2PYRIDYLCARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
ethyl5benzyl2(((2(pyridin2ylcarbonyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
ETHYL5BENZYL2((PYRIDINE2CARBONYLAMINO)CARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC21H20N4O3S2c122820(27)161315(12148435914)3019(16)2321(29)252418(26)171067112217h31113H212H21H3(H2426)(H2232529)
MFCD03944737
ZINC000019632035
ZINC19632035
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