Vitas-M small molecule compound
4-chloro-N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-nitrobenzamide
Catalog ID
STL338153
SMILES COc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccccc1
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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 C25H19ClN6O4 MW 502.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN6O4/c1-36-18-10-7-16(8-11-18)21-14-20(15-5-3-2-4-6-15)27-25-29-24(30-31(21)25)28-23(33)17-9-12-19(26)22(13-17)32(34)35/h2-14,21H,1H3,(H2,27,28,29,30,33)InChIKey
LYLVPPXHHOJXOG-UHFFFAOYSA-NSynonyms
4CHLORON(7(4METHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)3NITROBENZAMIDE
4chloroN(7(4methoxyphenyl)5phenyl47dihydro(124)triazolo(15a)pyrimidin2yl)3nitrobenzamide
4chloroN(7(4methoxyphenyl)5phenyl47dihydro(124)triazolo(15a)pyrimidin2yl)3nitrobenzamidehydrochloride
COC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)NC(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C5=CC=CC=C5
COc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)c1ccccc1
COc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)c1ccccc1Cl
InChI=1SC25H19ClN6O4c1361810716(81118)211420(155324615)27252924(3031(21)25)2823(33)1791219(26)22(1317)32(34)35h21421H1H3(H22728293033)
MFCD03684074
ZINC000100998395
ZINC000100998400
Check stock
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Check stock on Vitas-MAvailable files
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