Vitas-M small molecule compound
2-{[5-benzyl-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,6-dimethylpiperidin-1-yl)ethanone
Catalog ID
STK102329
SMILES COc1ccc(cc1)n1c(SCC(=O)N2C(C)CCCC2C)nnc1Cc1ccccc1
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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 C25H30N4O2S MW 450.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O2S/c1-18-8-7-9-19(2)28(18)24(30)17-32-25-27-26-23(16-20-10-5-4-6-11-20)29(25)21-12-14-22(31-3)15-13-21/h4-6,10-15,18-19H,7-9,16-17H2,1-3H3InChIKey
PZWGHXVBOCIATD-UHFFFAOYSA-NSynonyms
1(26DIMETHYLPIPERIDYL)2(4(4METHOXYPHENYL)5BENZYL(124TRIAZOL3YLTHIO))ETHAN1ONE
2((5BENZYL4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(26DIMETHYLPIPERIDIN1YL)ETHANONE
2((5BENZYL4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(26DIMETHYLPIPERIDIN1YL)ETHANONE
4(3BENZYL5((2(26DIMETHYL1PIPERIDINYL)2OXOETHYL)SULFANYL)4H124TRIAZOL4YL)PHENYLMETHYLETHER
CC1CCCC(N1C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)CC4=CC=CC=C4)C
InChI=1SC25H30N4O2Sc11887919(2)28(18)24(30)173225272623(1620105461120)29(25)21121422(313)151321h4610151819H791617H213H3
MFCD03861995
ZINC000000663969
ZINC000013452078
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