Vitas-M small molecule compound
(2E)-3-(4-methoxyphenyl)-N-[7-(4-methoxyphenyl)-5-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide
Catalog ID
STL234447
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1nc2n(n1)C(CC(N2)c1ccccc1)c1ccc(cc1)OC
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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 C28H27N5O3 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O3/c1-35-22-13-8-19(9-14-22)10-17-26(34)30-27-31-28-29-24(20-6-4-3-5-7-20)18-25(33(28)32-27)21-11-15-23(36-2)16-12-21/h3-17,24-25H,18H2,1-2H3,(H2,29,30,31,32,34)/b17-10+InChIKey
MTJJBLXXBUVGHT-LICLKQGHSA-NSynonyms
848212-86-2(2E)3(4methoxyphenyl)N(7(4methoxyphenyl)5phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)prop2enamide
(E)3(4methoxyphenyl)N(7(4methoxyphenyl)5phenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)prop2enamide
(E)3(4methoxyphenyl)N(7(4methoxyphenyl)5phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)acrylamide
848212862
COC1=CC=C(C=C1)C=CC(=O)NC2=NC3=NC(CC(N3N2)C4=CC=C(C=C4)OC)C5=CC=CC=C5
COc1ccc(cc1)C=CC(=O)Nc1nc2n(n1)C(CC(N2)c1ccccc1)c1ccc(cc1)OC
InChI=1SC28H27N5O3c1352213819(91422)101726(34)302731282924(206435720)1825(33(28)3227)21111523(362)161221h3172425H18H212H3(H22930313234)b1710+
MFCD04188705
ZINC000002423876
ZINC000013778600
Check stock
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Check stock on Vitas-MAvailable files
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