Vitas-M small molecule compound
[7-(4-methylphenyl)-5-phenyl-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](4-nitrophenyl)methanone
Catalog ID
STK222389
SMILES Cc1ccc(cc1)C1CC(c2ccccc2)N(c2n1ncn2)C(=O)c1ccc(cc1)[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 C25H21N5O3 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O3/c1-17-7-9-19(10-8-17)23-15-22(18-5-3-2-4-6-18)28(25-26-16-27-29(23)25)24(31)20-11-13-21(14-12-20)30(32)33/h2-14,16,22-23H,15H2,1H3InChIKey
SLGNPWHSIIKNRG-UHFFFAOYSA-NSynonyms
(7(4METHYLPHENYL)5PHENYL67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN4(5H)YL)(4NITROPHENYL)METHANONE
(7(4methylphenyl)5phenyl67dihydro5H(124)triazolo(15a)pyrimidin4yl)(4nitrophenyl)methanone
CC1=CC=C(C=C1)C2CC(N(C3=NC=NN23)C(=O)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=CC=C5
Cc1ccc(cc1)C1CC(c2ccccc2)N(c2n1ncn2)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H21N5O3c1177919(10817)231522(185324618)28(2526162729(23)25)24(31)20111321(141220)30(32)33h214162223H15H21H3
MFCD08671852
ZINC000010060323
ZINC000010060326
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