Vitas-M small molecule compound
2-({5-[1-(2-chloro-5-methylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cycloheptylacetamide
Catalog ID
STK469937
SMILES CC(c1nnc(n1C)SCC(=O)NC1CCCCCC1)Oc1cc(C)ccc1Cl
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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 C21H29ClN4O2S MW 437.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29ClN4O2S/c1-14-10-11-17(22)18(12-14)28-15(2)20-24-25-21(26(20)3)29-13-19(27)23-16-8-6-4-5-7-9-16/h10-12,15-16H,4-9,13H2,1-3H3,(H,23,27)InChIKey
VVPPLDNNNSBJIO-UHFFFAOYSA-NSynonyms
2((5(1(2chloro5methylphenoxy)ethyl)4methyl124triazol3yl)sulfanyl)Ncycloheptylacetamide
2((5(1(2chloro5methylphenoxy)ethyl)4methyl4H124triazol3yl)sulfanyl)Ncycloheptylacetamide
2(5((2CHLORO5METHYLPHENOXY)ETHYL)4METHYL(124TRIAZOL3YLTHIO))NCYCLOHEPTYLACETAMIDE
CC1=CC(=C(C=C1)Cl)OC(C)C2=NN=C(N2C)SCC(=O)NC3CCCCCC3
InChI=1SC21H29ClN4O2Sc114101117(22)18(1214)2815(2)20242521(26(20)3)291319(27)231686457916h10121516H4913H213H3(H2327)
MFCD07186195
ZINC000017101017
ZINC000017101019
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