Vitas-M small molecule compound
N-(4-methoxyphenyl)-2-({5-[(3-methyl-4-nitrophenoxy)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK437113
SMILES COc1ccc(cc1)NC(=O)CSc1nnc(n1CC1CCCO1)COc1ccc(c(c1)C)[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 C24H27N5O6S MW 513.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O6S/c1-16-12-19(9-10-21(16)29(31)32)35-14-22-26-27-24(28(22)13-20-4-3-11-34-20)36-15-23(30)25-17-5-7-18(33-2)8-6-17/h5-10,12,20H,3-4,11,13-15H2,1-2H3,(H,25,30)InChIKey
DSZNVVTYTFRCSO-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)OCC2=NN=C(N2CC3CCCO3)SCC(=O)NC4=CC=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1)NC(=O)CSc1nnc(n1CC1CCCO1)COc1ccc(c(c1)C)(N+)(=O)(O)
InChI=1SC24H27N5O6Sc1161219(91021(16)29(31)32)351422262724(28(22)132043113420)361523(30)25175718(332)8617h5101220H34111315H212H3(H2530)
MFCD03944587
N(4METHOXYPHENYL)2((5((3METHYL4NITROPHENOXY)METHYL)4(OXOLAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4methoxyphenyl)2((5((3methyl4nitrophenoxy)methyl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(4METHOXYPHENYL)2(5((3METHYL4NITROPHENOXY)METHYL)4(OXOLAN2YLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000020352834
ZINC000020352837
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.