Vitas-M small molecule compound
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Catalog ID
STK211105
SMILES Cc1nnc(s1)SCc1cc(=O)[nH]c(n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C20H22N6O3S2 MW 458.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O3S2/c1-13-23-24-20(31-13)30-11-15-9-18(27)22-19(21-15)26-6-4-25(5-7-26)10-14-2-3-16-17(8-14)29-12-28-16/h2-3,8-9H,4-7,10-12H2,1H3,(H,21,22,27)InChIKey
PFPHBWSUNDRTBF-UHFFFAOYSA-NSynonyms
878974-73-32(4(13BENZODIOXOL5YLMETHYL)1PIPERAZINYL)6(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)4(3H)PYRIMIDINONE
2(4(13benzodioxol5ylmethyl)piperazin1yl)6(((5methyl134thiadiazol2yl)sulfanyl)methyl)pyrimidin4(3H)one
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)6((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)1HPYRIMIDIN4ONE
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)6((5METHYL(134THIADIAZOL2YLTHIO))METHYL)3HYDROPYRIMIDIN4ONE
2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)6(((5methyl134thiadiazol2yl)thio)methyl)pyrimidin4(3H)one
878974733
CC1=NN=C(S1)SCC2=CC(=O)N=C(N2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
Cc1nnc(s1)SCc1cc(=O)(nH)c(n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC20H22N6O3S2c113232420(3113)301115918(27)2219(2115)266425(5726)1014231617(814)29122816h2389H471012H21H3(H212227)
MFCD06754741
ZINC9012193
Check stock
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Check stock on Vitas-MAvailable files
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