Vitas-M small molecule compound
N-[3,5-dimethyl-1-(4-methylbenzyl)-1H-pyrazol-4-yl]-5-(3-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Catalog ID
STL404770
SMILES Cc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1cc(nc2n1ncn2)c1cccc(c1)[N+](=O)[O-])C
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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 C25H22N8O3 MW 482.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N8O3/c1-15-7-9-18(10-8-15)13-31-17(3)23(16(2)30-31)29-24(34)22-12-21(28-25-26-14-27-32(22)25)19-5-4-6-20(11-19)33(35)36/h4-12,14H,13H2,1-3H3,(H,29,34)InChIKey
WUANBUGVLGDBRB-UHFFFAOYSA-NSynonyms
1174845-07-81174845078
CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)NC(=O)C3=CC(=NC4=NC=NN34)C5=CC(=CC=C5)(N+)(=O)(O))C
Cc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1cc(nc2n1ncn2)c1cccc(c1)(N+)(=O)(O))C
InChI=1SC25H22N8O3c1157918(10815)133117(3)23(16(2)3031)2924(34)221221(282526142732(22)25)1954620(1119)33(35)36h41214H13H213H3(H2934)
MFCD10701930
N(35dimethyl1((4methylphenyl)methyl)pyrazol4yl)5(3nitrophenyl)(124)triazolo(15a)pyrimidine7carboxamide
N(35dimethyl1(4methylbenzyl)1Hpyrazol4yl)5(3nitrophenyl)(124)triazolo(15a)pyrimidine7carboxamide
ZINC000036619491
ZINC36619491
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