Vitas-M small molecule compound
(2E)-N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STK650910
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)OC)c1ccc(cc1)Cl
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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 C28H24ClN5O3 MW 513.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN5O3/c1-36-22-12-3-18(4-13-22)5-16-26(35)31-27-32-28-30-24(19-6-10-21(29)11-7-19)17-25(34(28)33-27)20-8-14-23(37-2)15-9-20/h3-17,25H,1-2H3,(H2,30,31,32,33,35)/b16-5+InChIKey
VBUYUKCEWDIMGC-FZSIALSZSA-NSynonyms
836638-01-8(2E)N(5(4chlorophenyl)7(4methoxyphenyl)37dihydro(124)triazolo(15a)pyrimidin2yl)3(4methoxyphenyl)prop2enamide
(E)N(5(4CHLOROPHENYL)7(4METHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)3(4METHOXYPHENYL)PROP2ENAMIDE
836638018
COC1=CC=C(C=C1)C=CC(=O)NC2=NC3=NC(=CC(N3N2)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)Cl
COc1ccc(cc1)C=CC(=O)Nc1(nH)c2=NC(=CC(n2n1)c1ccc(cc1)OC)c1ccc(cc1)Cl
InChI=1SC28H24ClN5O3c1362212318(41322)51626(35)312732283024(1961021(29)11719)1725(34(28)3327)2081423(372)15920h31725H12H3(H23031323335)b165+
MFCD18165782
ZINC000009462338
ZINC000009462340
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