Vitas-M small molecule compound
5-[(3,4-dichlorobenzyl)oxy]-N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-pyran-2-carboxamide
Catalog ID
STK939140
SMILES COCc1n[nH]/c(=N/C(=O)c2occ(c(=O)c2)OCc2ccc(c(c2)Cl)Cl)/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 C17H13Cl2N3O5S MW 442.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2N3O5S/c1-25-8-15-21-22-17(28-15)20-16(24)13-5-12(23)14(7-27-13)26-6-9-2-3-10(18)11(19)4-9/h2-5,7H,6,8H2,1H3,(H,20,22,24)InChIKey
FBDHIRMLRUWPMA-UHFFFAOYSA-NSynonyms
1190259-98-31190259983
5((34dichlorobenzyl)oxy)N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)4oxo4Hpyran2carboxamide
5((34dichlorophenyl)methoxy)N(5(methoxymethyl)134thiadiazol2yl)4oxopyran2carboxamide
COCC1=NN=C(S1)NC(=O)C2=CC(=O)C(=CO2)OCC3=CC(=C(C=C3)Cl)Cl
COCc1n(nH)c(=NC(=O)c2occ(c(=O)c2)OCc2ccc(c(c2)Cl)Cl)s1
InChI=1SC17H13Cl2N3O5Sc125815212217(2815)2016(24)13512(23)14(72713)26692310(18)11(19)49h257H68H21H3(H202224)
MFCD18179169
ZINC000036357114
ZINC36357114
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