Vitas-M small molecule compound
3-(4-methoxyphenyl)-6-(3-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK297963
SMILES COc1ccc(cc1)c1nnc2n1nc(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 C16H11N5O3S MW 353.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N5O3S/c1-24-13-7-5-10(6-8-13)14-17-18-16-20(14)19-15(25-16)11-3-2-4-12(9-11)21(22)23/h2-9H,1H3InChIKey
TUBDJULBEISUNY-UHFFFAOYSA-NSynonyms
879564-20-23(4METHOXYPHENYL)6(3NITROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
879564202
COC1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1)c1nnc2n1nc(s2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H11N5O3Sc124137510(6813)1417181620(14)1915(2516)1132412(911)21(22)23h29H1H3
MFCD06794130
ZINC000005351197
ZINC05351197
ZINC5351197
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