Vitas-M small molecule compound
2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl 3,4-dimethylbenzoate
Catalog ID
STL014054
SMILES O=C(Nc1[nH]nc(c1)C)COC(=O)c1ccc(c(c1)C)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 C15H17N3O3 MW 287.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O3/c1-9-4-5-12(6-10(9)2)15(20)21-8-14(19)16-13-7-11(3)17-18-13/h4-7H,8H2,1-3H3,(H2,16,17,18,19)InChIKey
GDWFYAYMJFPOHC-UHFFFAOYSA-NSynonyms
(2((5methyl1Hpyrazol3yl)amino)2oxoethyl)34dimethylbenzoate
2((3methyl1Hpyrazol5yl)amino)2oxoethyl34dimethylbenzoate
CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=NNC(=C2)C)C
InChI=1SC15H17N3O3c194512(610(9)2)15(20)21814(19)1613711(3)171813h47H8H213H3(H216171819)
MFCD18186311
O=C(Nc1(nH)nc(c1)C)COC(=O)c1ccc(c(c1)C)C
ZINC000051356794
ZINC51356794
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