Vitas-M small molecule compound

N-[1-(4-methylbenzyl)-1H-1,2,4-triazol-3-yl][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

Catalog ID
STL178205
SMILES Cc1ccc(cc1)Cn1cnc(n1)NC(=O)c1nn2c(n1)nccc2

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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 C16H14N8O MW 334.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N8O/c1-11-3-5-12(6-4-11)9-23-10-18-15(22-23)20-14(25)13-19-16-17-7-2-8-24(16)21-13/h2-8,10H,9H2,1H3,(H,20,22,25)
InChIKey
QICXKIZYVDFJRU-UHFFFAOYSA-N
Synonyms
832143-86-9
832143869
CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)C3=NN4C=CC=NC4=N3
InChI=1SC16H14N8Oc1113512(6411)923101815(2223)2014(25)1319161772824(16)2113h2810H9H21H3(H202225)
MFCD04059398
N(1((4methylphenyl)methyl)124triazol3yl)(124)triazolo(15a)pyrimidine2carboxamide
N(1(4methylbenzyl)1H124triazol3yl)(124)triazolo(15a)pyrimidine2carboxamide
ZINC000002808729
ZINC02808729
ZINC2808729

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.