Vitas-M small molecule compound
[7-(2-methoxyphenyl)-5-phenyl-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](3-nitrophenyl)methanone
Catalog ID
STK222508
SMILES COc1ccccc1C1CC(c2ccccc2)N(c2n1ncn2)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-34-23-13-6-5-12-20(23)22-15-21(17-8-3-2-4-9-17)28(25-26-16-27-29(22)25)24(31)18-10-7-11-19(14-18)30(32)33/h2-14,16,21-22H,15H2,1H3InChIKey
CURHWWJWBBIZPA-UHFFFAOYSA-NSynonyms
(7(2METHOXYPHENYL)5PHENYL67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN4(5H)YL)(3NITROPHENYL)METHANONE
(7(2methoxyphenyl)5phenyl67dihydro5H(124)triazolo(15a)pyrimidin4yl)(3nitrophenyl)methanone
COC1=CC=CC=C1C2CC(N(C3=NC=NN23)C(=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CC=C5
COc1ccccc1C1CC(c2ccccc2)N(c2n1ncn2)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC25H21N5O4c1342313651220(23)221521(178324917)28(2526162729(22)25)24(31)181071119(1418)30(32)33h214162122H15H21H3
MFCD08671912
ZINC000010060407
ZINC000010060410
ZINC10060409
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