Vitas-M small molecule compound
ethyl 5-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-1,2,3-thiadiazole-4-carboxylate
Catalog ID
STL438145
SMILES CCOC(=O)c1nnsc1N/N=C/c1ccc2c(c1)OCO2
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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 C13H12N4O4S MW 320.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O4S/c1-2-19-13(18)11-12(22-17-15-11)16-14-6-8-3-4-9-10(5-8)21-7-20-9/h3-6,16H,2,7H2,1H3/b14-6+InChIKey
VNFOWTJUQNXUTQ-MKMNVTDBSA-NSynonyms
CCOC(=O)C1=C(SN=N1)NN=CC2=CC3=C(C=C2)OCO3
CCOC(=O)c1nnsc1NN=Cc1ccc2c(c1)OCO2
ethyl5((2E)2(13benzodioxol5ylmethylidene)hydrazinyl)123thiadiazole4carboxylate
ethyl5((2E)2(13benzodioxol5ylmethylidene)hydrazinyl)thiadiazole4carboxylate
InChI=1SC13H12N4O4Sc121913(18)1112(22171511)16146834910(58)217209h3616H27H21H3b146+
MFCD06242427
ZINC000004478096
ZINC35227720
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