Vitas-M small molecule compound
N-(2-cyanophenyl)-2-({5-[1-(4-methoxyphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK401470
SMILES COc1ccc(cc1)OC(c1nnc(n1C)SCC(=O)Nc1ccccc1C#N)C
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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 C21H21N5O3S MW 423.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3S/c1-14(29-17-10-8-16(28-3)9-11-17)20-24-25-21(26(20)2)30-13-19(27)23-18-7-5-4-6-15(18)12-22/h4-11,14H,13H2,1-3H3,(H,23,27)InChIKey
ATEJNPRGPKBMAN-UHFFFAOYSA-NSynonyms
CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2C#N)OC3=CC=C(C=C3)OC
InChI=1SC21H21N5O3Sc114(291710816(283)91117)20242521(26(20)2)301319(27)2318754615(18)1222h41114H13H213H3(H2327)
MFCD11853824
N(2cyanophenyl)2((5(1(4methoxyphenoxy)ethyl)4methyl124triazol3yl)sulfanyl)acetamide
N(2cyanophenyl)2((5(1(4methoxyphenoxy)ethyl)4methyl4H124triazol3yl)sulfanyl)acetamide
ZINC000020098229
ZINC000020098230
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Check stock on Vitas-MAvailable files
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