Vitas-M small molecule compound

N-(4-ethylphenyl)-7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Catalog ID
STK308666
SMILES CCc1ccc(cc1)NC(=O)c1cnn2c1nccc2c1cccc(c1)[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 C21H17N5O3 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3/c1-2-14-6-8-16(9-7-14)24-21(27)18-13-23-25-19(10-11-22-20(18)25)15-4-3-5-17(12-15)26(28)29/h3-13H,2H2,1H3,(H,24,27)
InChIKey
NXDWWNZKSLAPJV-UHFFFAOYSA-N
Synonyms
769931-16-0
769931160
CCC1=CC=C(C=C1)NC(=O)C2=C3N=CC=C(N3N=C2)C4=CC(=CC=C4)(N+)(=O)(O)
CCc1ccc(cc1)NC(=O)c1cnn2c1nccc2c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H17N5O3c12146816(9714)2421(27)1813232519(10112220(18)25)1543517(1215)26(28)29h313H2H21H3(H2427)
MFCD04051247
N(4ethylphenyl)7(3nitrophenyl)pyrazolo(15a)pyrimidine3carboxamide
ZINC000002797852
ZINC02797852
ZINC2797852

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Available files

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