Vitas-M small molecule compound
N-[1-(2,4-dimethylphenyl)ethyl]-5-(3-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Catalog ID
STL181273
SMILES Cc1ccc(c(c1)C)C(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 C22H20N6O3 MW 416.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O3/c1-13-7-8-18(14(2)9-13)15(3)25-21(29)20-11-19(26-22-23-12-24-27(20)22)16-5-4-6-17(10-16)28(30)31/h4-12,15H,1-3H3,(H,25,29)InChIKey
YGERRBUGOFFONA-UHFFFAOYSA-NSynonyms
1174845-99-81174845998
CC1=CC(=C(C=C1)C(C)NC(=O)C2=CC(=NC3=NC=NN23)C4=CC(=CC=C4)(N+)(=O)(O))C
Cc1ccc(c(c1)C)C(NC(=O)c1cc(nc2n1ncn2)c1cccc(c1)(N+)(=O)(O))C
InChI=1SC22H20N6O3c1137818(14(2)913)15(3)2521(29)201119(262223122427(20)22)1654617(1016)28(30)31h41215H13H3(H2529)
MFCD10701972
N(1(24dimethylphenyl)ethyl)5(3nitrophenyl)(124)triazolo(15a)pyrimidine7carboxamide
ZINC000036619544
ZINC000036619545
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