Vitas-M small molecule compound
3-(4-methoxybenzyl)-6-[(E)-2-(4-nitrophenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK242340
SMILES COc1ccc(cc1)Cc1nnc2n1nc(s2)/C=C/c1ccc(cc1)[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 C19H15N5O3S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O3S/c1-27-16-9-4-14(5-10-16)12-17-20-21-19-23(17)22-18(28-19)11-6-13-2-7-15(8-3-13)24(25)26/h2-11H,12H2,1H3/b11-6+InChIKey
KKOKCKNCLFTJAA-IZZDOVSWSA-NSynonyms
3((4methoxyphenyl)methyl)6((E)2(4nitrophenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
3(4methoxybenzyl)6((E)2(4nitrophenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=C(C=C1)CC2=NN=C3N2N=C(S3)C=CC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)Cc1nnc2n1nc(s2)C=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H15N5O3Sc127169414(51016)121720211923(17)2218(2819)116132715(8313)24(25)26h211H12H21H3b116+
MFCD08684054
ZINC000008392993
ZINC08392993
ZINC8392993
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