Vitas-M small molecule compound

2,2-dimethyl-3-{[3-(4H-1,2,4-triazol-4-yl)phenyl]carbamoyl}cyclopropanecarboxylic acid

Catalog ID
STL251584
SMILES O=C(C1C(C1(C)C)C(=O)O)Nc1cccc(c1)n1cnnc1

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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 C15H16N4O3 MW 300.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O3/c1-15(2)11(12(15)14(21)22)13(20)18-9-4-3-5-10(6-9)19-7-16-17-8-19/h3-8,11-12H,1-2H3,(H,18,20)(H,21,22)
InChIKey
BWYKPZFFJZEABP-UHFFFAOYSA-N
Synonyms
1324057-29-5
1324057295
22dimethyl3((3(124triazol4yl)phenyl)carbamoyl)cyclopropane1carboxylicacid
22dimethyl3((3(4H124triazol4yl)phenyl)carbamoyl)cyclopropanecarboxylicacid
3((3(4H124triazol4yl)phenyl)carbamoyl)22dimethylcyclopropanecarboxylicacid
CC1(C(C1C(=O)O)C(=O)NC2=CC=CC(=C2)N3C=NN=C3)C
InChI=1SC15H16N4O3c115(2)11(12(15)14(21)22)13(20)18943510(69)1971617819h381112H12H3(H1820)(H2122)
MFCD19713103
ZINC000071288498
ZINC000071288503

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Available files

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