Vitas-M small molecule compound
4-(4-methoxyphenyl)-3-[(4-nitrobenzyl)sulfanyl]-5-(thiophen-2-yl)-4H-1,2,4-triazole
Catalog ID
STK807110
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccs1
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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 C20H16N4O3S2 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O3S2/c1-27-17-10-8-15(9-11-17)23-19(18-3-2-12-28-18)21-22-20(23)29-13-14-4-6-16(7-5-14)24(25)26/h2-12H,13H2,1H3InChIKey
XVSFZSPKIVYSCV-UHFFFAOYSA-NSynonyms
4(4METHOXYPHENYL)3(((4NITROPHENYL)METHYL)SULFANYL)5(THIOPHEN2YL)4H124TRIAZOLE
4(4methoxyphenyl)3((4nitrobenzyl)sulfanyl)5(thiophen2yl)4H124triazole
4(4METHOXYPHENYL)3((4NITROPHENYL)METHYLSULFANYL)5THIOPHEN2YL124TRIAZOLE
4METHOXY1(3((4NITROPHENYL)METHYLTHIO)5(2THIENYL)(124TRIAZOL4YL))BENZENE
COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CS4
COc1ccc(cc1)n1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1cccs1
InChI=1SC20H16N4O3S2c1271710815(91117)2319(1832122818)212220(23)2913144616(7514)24(25)26h212H13H21H3
MFCD03621262
ZINC000002446081
ZINC02446081
ZINC2446081
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