Vitas-M small molecule compound
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)butanamide
Catalog ID
STK779117
SMILES O=C(Nc1ccc(cc1C)I)CCCn1nc(c(c1C)[N+](=O)[O-])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 C16H19IN4O3 MW 442.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19IN4O3/c1-10-9-13(17)6-7-14(10)18-15(22)5-4-8-20-12(3)16(21(23)24)11(2)19-20/h6-7,9H,4-5,8H2,1-3H3,(H,18,22)InChIKey
NHUVBZFUCBSWTA-UHFFFAOYSA-NSynonyms
4(35dimethyl4nitro1Hpyrazol1yl)N(4iodo2methylphenyl)butanamide
4(35DIMETHYL4NITROPYRAZOL1YL)N(4IODO2METHYLPHENYL)BUTANAMIDE
CC1=C(C=CC(=C1)I)NC(=O)CCCN2C(=C(C(=N2)C)(N+)(=O)(O))C
InChI=1SC16H19IN4O3c110913(17)6714(10)1815(22)5482012(3)16(21(23)24)11(2)1920h679H458H213H3(H1822)
MFCD05858035
O=C(Nc1ccc(cc1C)I)CCCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000001428856
ZINC01428856
ZINC1428856
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