Vitas-M small molecule compound
5-[(4-chlorobenzyl)oxy]-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-pyran-2-carboxamide
Catalog ID
STL160239
SMILES COCc1n[nH]/c(=N\C(=O)c2occ(c(=O)c2)OCc2ccc(cc2)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 C17H14ClN3O5S MW 407.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O5S/c1-24-9-15-20-21-17(27-15)19-16(23)13-6-12(22)14(8-26-13)25-7-10-2-4-11(18)5-3-10/h2-6,8H,7,9H2,1H3,(H,19,21,23)InChIKey
YXRMJYXEGNYALJ-UHFFFAOYSA-NSynonyms
1282124-56-41282124564
5((4chlorobenzyl)oxy)N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)4oxo4Hpyran2carboxamide
5((4chlorophenyl)methoxy)N(5(methoxymethyl)134thiadiazol2yl)4oxopyran2carboxamide
COCC1=NN=C(S1)NC(=O)C2=CC(=O)C(=CO2)OCC3=CC=C(C=C3)Cl
COCc1n(nH)c(=NC(=O)c2occ(c(=O)c2)OCc2ccc(cc2)Cl)s1
InChI=1SC17H14ClN3O5Sc124915202117(2715)1916(23)13612(22)14(82613)257102411(18)5310h268H79H21H3(H192123)
MFCD20758949
ZINC000061721998
ZINC61721998
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