Vitas-M small molecule compound
3-(4-methoxybenzyl)-6-(3-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK242334
SMILES COc1ccc(cc1)Cc1nnc2n1nc(s2)c1cccc(c1)[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 C17H13N5O3S MW 367.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O3S/c1-25-14-7-5-11(6-8-14)9-15-18-19-17-21(15)20-16(26-17)12-3-2-4-13(10-12)22(23)24/h2-8,10H,9H2,1H3InChIKey
LNWQGPOGLNSEEV-UHFFFAOYSA-NSynonyms
3((4methoxyphenyl)methyl)6(3nitrophenyl)(124)triazolo(34b)(134)thiadiazole
3(4methoxybenzyl)6(3nitrophenyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=C(C=C1)CC2=NN=C3N2N=C(S3)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1)Cc1nnc2n1nc(s2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC17H13N5O3Sc125147511(6814)91518191721(15)2016(2617)1232413(1012)22(23)24h2810H9H21H3
MFCD08684043
ZINC000008392893
ZINC08392893
ZINC8392893
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