Vitas-M small molecule compound

propan-2-yl 4-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate

Catalog ID
STK915480
SMILES CCn1ncc(c1C(=O)Nc1ccc(cc1)C(=O)OC(C)C)Br

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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 C16H18BrN3O3 MW 380.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN3O3/c1-4-20-14(13(17)9-18-20)15(21)19-12-7-5-11(6-8-12)16(22)23-10(2)3/h5-10H,4H2,1-3H3,(H,19,21)
InChIKey
PQCYGOOWNHMIIA-UHFFFAOYSA-N
Synonyms
492426-45-6
492426456
CCN1C(=C(C=N1)Br)C(=O)NC2=CC=C(C=C2)C(=O)OC(C)C
InChI=1SC16H18BrN3O3c142014(13(17)91820)15(21)19127511(6812)16(22)2310(2)3h510H4H213H3(H1921)
ISOPROPYL4(((4BROMO1ETHYL1HPYRAZOL5YL)CARBONYL)AMINO)BENZOATE
MFCD02175322
propan2yl4(((4bromo1ethyl1Hpyrazol5yl)carbonyl)amino)benzoate
PROPAN2YL4((4BROMO2ETHYLPYRAZOLE3CARBONYL)AMINO)BENZOATE
ZINC000001144597
ZINC01144597
ZINC1144597

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Available files

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