Vitas-M small molecule compound
[5-(4-methylphenyl)-7-phenyl-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](2-nitrophenyl)methanone
Catalog ID
STK219630
SMILES Cc1ccc(cc1)C1CC(c2ccccc2)n2c(N1C(=O)c1ccccc1[N+](=O)[O-])ncn2
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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/c1-17-11-13-19(14-12-17)22-15-23(18-7-3-2-4-8-18)29-25(26-16-27-29)28(22)24(31)20-9-5-6-10-21(20)30(32)33/h2-14,16,22-23H,15H2,1H3InChIKey
NJKYZRSTXAXTIQ-UHFFFAOYSA-NSynonyms
(5(4METHYLPHENYL)7PHENYL67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN4(5H)YL)(2NITROPHENYL)METHANONE
(5(4methylphenyl)7phenyl67dihydro5H(124)triazolo(15a)pyrimidin4yl)(2nitrophenyl)methanone
CC1=CC=C(C=C1)C2CC(N3C(=NC=N3)N2C(=O)C4=CC=CC=C4(N+)(=O)(O))C5=CC=CC=C5
Cc1ccc(cc1)C1CC(c2ccccc2)n2c(N1C(=O)c1ccccc1(N+)(=O)(O))ncn2
InChI=1SC25H21N5O3c117111319(141217)221523(187324818)2925(26162729)28(22)24(31)209561021(20)30(32)33h214162223H15H21H3
MFCD08671824
ZINC000010059799
ZINC000010059802
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