Vitas-M small molecule compound

methyl 7-(3-chloro-4-methylphenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate

Catalog ID
STK541437
SMILES COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1ccc(c(c1)Cl)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 C15H14ClN3O4 MW 335.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClN3O4/c1-8-3-4-9(5-10(8)16)19-12(20)7-15(14(19)22)6-11(17-18-15)13(21)23-2/h3-5,18H,6-7H2,1-2H3
InChIKey
MZCFCKPOAIXPCV-UHFFFAOYSA-N
Synonyms
385390-20-5
385390205
CC1=C(C=C(C=C1)N2C(=O)CC3(C2=O)CC(=NN3)C(=O)OC)Cl
InChI=1SC15H14ClN3O4c18349(510(8)16)1912(20)715(14(19)22)611(171815)13(21)232h3518H67H212H3
methyl7(3chloro4methylphenyl)68dioxo127triazaspiro(44)non2ene3carboxylate
METHYL8(3CHLORO4METHYLPHENYL)79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
MFCD03285662
ZINC000000547909
ZINC000000547910

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Available files

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