Vitas-M small molecule compound
(2E)-3-(4-chlorophenyl)-N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide
Catalog ID
STK659385
SMILES COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)/C=C/c1ccc(cc1)Cl)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 C27H21Cl2N5O2 MW 518.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21Cl2N5O2/c1-36-22-13-7-19(8-14-22)24-16-23(18-5-11-21(29)12-6-18)30-27-32-26(33-34(24)27)31-25(35)15-4-17-2-9-20(28)10-3-17/h2-16,24H,1H3,(H2,30,31,32,33,35)/b15-4+InChIKey
AFELWXOFCIODJH-SYZQJQIISA-NSynonyms
836645-33-1(2E)3(4chlorophenyl)N(5(4chlorophenyl)7(4methoxyphenyl)37dihydro(124)triazolo(15a)pyrimidin2yl)prop2enamide
(E)3(4CHLOROPHENYL)N(5(4CHLOROPHENYL)7(4METHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)PROP2ENAMIDE
836645331
COC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)NC(=O)C=CC4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl
COc1ccc(cc1)C1C=C(N=c2n1nc((nH)2)NC(=O)C=Cc1ccc(cc1)Cl)c1ccc(cc1)Cl
InChI=1SC27H21Cl2N5O2c1362213719(81422)241623(1851121(29)12618)30273226(3334(24)27)3125(35)154172920(28)10317h21624H1H3(H23031323335)b154+
MFCD18168701
ZINC000101016154
ZINC000101016155
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