Vitas-M small molecule compound
(4-chloro-3-nitrophenyl)(5,7-diphenyl-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl)methanone
Catalog ID
STK219618
SMILES O=C(N1C(CC(n2c1ncn2)c1ccccc1)c1ccccc1)c1ccc(c(c1)[N+](=O)[O-])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 C24H18ClN5O3 MW 459.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN5O3/c25-19-12-11-18(13-22(19)30(32)33)23(31)28-20(16-7-3-1-4-8-16)14-21(17-9-5-2-6-10-17)29-24(28)26-15-27-29/h1-13,15,20-21H,14H2InChIKey
ICNKPEAPFTZAJC-UHFFFAOYSA-NSynonyms
(4CHLORO3NITROPHENYL)(57DIPHENYL67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN4(5H)YL)METHANONE
(4chloro3nitrophenyl)(57diphenyl67dihydro5H(124)triazolo(15a)pyrimidin4yl)methanone
C1C(N(C2=NC=NN2C1C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C5=CC=CC=C5
InChI=1SC24H18ClN5O3c2519121118(1322(19)30(32)33)23(31)2820(167314816)1421(1795261017)2924(28)26152729h113152021H14H2
MFCD08671816
O=C(N1C(CC(n2c1ncn2)c1ccccc1)c1ccccc1)c1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000010059779
ZINC000010059782
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