Vitas-M small molecule compound

5-[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-methoxy-5-methylphenyl)furan-2-carboxamide

Catalog ID
STK316360
SMILES COc1ccc(cc1NC(=O)c1ccc(o1)Cn1nc(c(c1C)Cl)[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 C18H17ClN4O5 MW 404.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O5/c1-10-4-6-14(27-3)13(8-10)20-18(24)15-7-5-12(28-15)9-22-11(2)16(19)17(21-22)23(25)26/h4-8H,9H2,1-3H3,(H,20,24)
InChIKey
KXUPYKDFSSYMMT-UHFFFAOYSA-N
Synonyms
491830-00-3
491830003
5((4CHLORO3NITRO5METHYL1HPYRAZOL1YL)METHYL)N(2METHOXY5METHYLPHENYL)2FURAMIDE
5((4chloro5methyl3nitro1Hpyrazol1yl)methyl)N(2methoxy5methylphenyl)furan2carboxamide
5((4CHLORO5METHYL3NITROPYRAZOL1YL)METHYL)N(2METHOXY5METHYLPHENYL)FURAN2CARBOXAMIDE
CC1=CC(=C(C=C1)OC)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)(N+)(=O)(O))Cl)C
COc1ccc(cc1NC(=O)c1ccc(o1)Cn1nc(c(c1C)Cl)(N+)(=O)(O))C
InChI=1SC18H17ClN4O5c1104614(273)13(810)2018(24)157512(2815)92211(2)16(19)17(2122)23(25)26h48H9H213H3(H2024)
MFCD03071523
ZINC000002761427
ZINC02761427
ZINC2761427

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Available files

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