Vitas-M small molecule compound

methyl 5-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-5-oxopentanoate

Catalog ID
STK034502
SMILES COC(=O)CCCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)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 C17H21N3O4 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O4/c1-12-16(18-14(21)10-7-11-15(22)24-3)17(23)20(19(12)2)13-8-5-4-6-9-13/h4-6,8-9H,7,10-11H2,1-3H3,(H,18,21)
InChIKey
IESPTJQUGUAITD-UHFFFAOYSA-N
Synonyms

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCCC(=O)OC
COC(=O)CCCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
InChI=1SC17H21N3O4c11216(1814(21)1071115(22)243)17(23)20(19(12)2)138546913h4689H71011H213H3(H1821)
METHYL5((15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)AMINO)5OXOPENTANOATE
METHYL5((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)5OXOPENTANOATE
MFCD03033923
STK034502
ZINC000006269042
ZINC06269042
ZINC6269042

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Available files

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