Vitas-M small molecule compound
1-methyl-5-({1-[4-(propan-2-yl)phenyl]ethyl}carbamoyl)-1H-pyrazole-4-carboxylic acid
Catalog ID
STL390845
SMILES CC(c1ccc(cc1)C(C)C)NC(=O)c1n(C)ncc1C(=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 C17H21N3O3 MW 315.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3/c1-10(2)12-5-7-13(8-6-12)11(3)19-16(21)15-14(17(22)23)9-18-20(15)4/h5-11H,1-4H3,(H,19,21)(H,22,23)InChIKey
UVPCFSPDOOPYJD-UHFFFAOYSA-NSynonyms
1methyl5((1(4(propan2yl)phenyl)ethyl)carbamoyl)1Hpyrazole4carboxylicacid
1methyl5(1(4propan2ylphenyl)ethylcarbamoyl)pyrazole4carboxylicacid
CC(C)C1=CC=C(C=C1)C(C)NC(=O)C2=C(C=NN2C)C(=O)O
InChI=1SC17H21N3O3c110(2)125713(8612)11(3)1916(21)1514(17(22)23)91820(15)4h511H14H3(H1921)(H2223)
MFCD09470517
ZINC000020614614
ZINC000020614616
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