Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-[3-(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)propyl]prop-2-enamide
Catalog ID
STK631507
SMILES O=C(/C=C/c1ccc2c(c1)OCO2)NCCCc1nnc2n1c(C)cc(n2)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 C20H21N5O3 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3/c1-13-10-14(2)25-18(23-24-20(25)22-13)4-3-9-21-19(26)8-6-15-5-7-16-17(11-15)28-12-27-16/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,21,26)/b8-6+InChIKey
UMAPHQZJGCWEMC-SOFGYWHQSA-NSynonyms
1021043-10-6(2E)3(13benzodioxol5yl)N(3(57dimethyl(124)triazolo(43a)pyrimidin3yl)propyl)prop2enamide
(E)3(13benzodioxol5yl)N(3(57dimethyl(124)triazolo(43a)pyrimidin3yl)propyl)prop2enamide
(E)3(benzo(d)(13)dioxol5yl)N(3(57dimethyl(124)triazolo(43a)pyrimidin3yl)propyl)acrylamide
1021043106
CC1=CC(=NC2=NN=C(N12)CCCNC(=O)C=CC3=CC4=C(C=C3)OCO4)C
InChI=1SC20H21N5O3c1131014(2)2518(232420(25)2213)4392119(26)8615571617(1115)28122716h581011H34912H212H3(H2126)b86+
MFCD12200354
O=C(C=Cc1ccc2c(c1)OCO2)NCCCc1nnc2n1c(C)cc(n2)C
ZINC000012323167
ZINC12323167
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