Vitas-M small molecule compound

N-(5-chloro-2-methylphenyl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide

Catalog ID
STK688684
SMILES O=C(Nc1cc(Cl)ccc1C)CCCn1nc(c(c1C)I)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 C16H19ClIN3O MW 431.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClIN3O/c1-10-6-7-13(17)9-14(10)19-15(22)5-4-8-21-12(3)16(18)11(2)20-21/h6-7,9H,4-5,8H2,1-3H3,(H,19,22)
InChIKey
WWWRJCAQYNFULC-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)Cl)NC(=O)CCCN2C(=C(C(=N2)C)I)C
InChI=1SC16H19ClIN3Oc1106713(17)914(10)1915(22)5482112(3)16(18)11(2)2021h679H458H213H3(H1922)
MFCD07658035
N(5chloro2methylphenyl)4(4iodo35dimethyl1Hpyrazol1yl)butanamide
N(5CHLORO2METHYLPHENYL)4(4IODO35DIMETHYLPYRAZOL1YL)BUTANAMIDE
ZINC000012462377
ZINC12462377

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Available files

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