Vitas-M small molecule compound
3-[(2-methoxy-5-nitrobenzyl)sulfanyl]-4,5-diphenyl-4H-1,2,4-triazole
Catalog ID
STK232940
SMILES COc1ccc(cc1CSc1nnc(n1c1ccccc1)c1ccccc1)[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 C22H18N4O3S MW 418.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3S/c1-29-20-13-12-19(26(27)28)14-17(20)15-30-22-24-23-21(16-8-4-2-5-9-16)25(22)18-10-6-3-7-11-18/h2-14H,15H2,1H3InChIKey
JOFZEELICZZWFB-UHFFFAOYSA-NSynonyms
3((2METHOXY5NITROBENZYL)SULFANYL)45DIPHENYL4H124TRIAZOLE
3((2METHOXY5NITROPHENYL)METHYLSULFANYL)45DIPHENYL124TRIAZOLE
COC1=C(C=C(C=C1)(N+)(=O)(O))CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
COc1ccc(cc1CSc1nnc(n1c1ccccc1)c1ccccc1)(N+)(=O)(O)
InChI=1SC22H18N4O3Sc12920131219(26(27)28)1417(20)153022242321(168425916)25(22)18106371118h214H15H21H3
MFCD04209357
ZINC000002835328
ZINC02835328
ZINC2835328
Check stock
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Check stock on Vitas-MAvailable files
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