Vitas-M small molecule compound
methyl 3-{[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-5-nitrobenzoate
Catalog ID
STK159109
SMILES CCOCc1nnc(s1)NC(=O)c1cc(cc(c1)C(=O)OC)[N+](=O)[O-]
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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 C14H14N4O6S MW 366.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O6S/c1-3-24-7-11-16-17-14(25-11)15-12(19)8-4-9(13(20)23-2)6-10(5-8)18(21)22/h4-6H,3,7H2,1-2H3,(H,15,17,19)InChIKey
YPJYXSUGINSAOG-UHFFFAOYSA-NSynonyms
701237-53-8701237538
CCOCC1=NN=C(S1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
CCOCc1nnc(s1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
InChI=1SC14H14N4O6Sc1324711161714(2511)1512(19)849(13(20)232)610(58)18(21)22h46H37H212H3(H151719)
METHYL3(((5(ETHOXYMETHYL)134THIADIAZOL2YL)AMINO)CARBONYL)5NITROBENZOATE
METHYL3((5(ETHOXYMETHYL)134THIADIAZOL2YL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(5(ETHOXYMETHYL)(134THIADIAZOL2YL))CARBAMOYL)3NITROBENZOATE
MFCD05661064
ZINC000002848382
ZINC02848382
ZINC2848382
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