Vitas-M small molecule compound

(2E)-2-[(2,5-dimethoxyphenyl)imino]-6-(3-methylpiperidin-1-yl)-5-nitro-2,3-dihydropyrimidin-4-amine

Catalog ID
STL054790
SMILES COc1ccc(cc1/N=c\1/nc(N2CCCC(C2)C)c(c([nH]1)N)[N+](=O)[O-])OC

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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 C18H24N6O4 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N6O4/c1-11-5-4-8-23(10-11)17-15(24(25)26)16(19)21-18(22-17)20-13-9-12(27-2)6-7-14(13)28-3/h6-7,9,11H,4-5,8,10H2,1-3H3,(H3,19,20,21,22)
InChIKey
FWHAOLIIUXQCPG-UHFFFAOYSA-N
Synonyms
714225-70-4
714225704
COc1ccc(cc1N=c1nc(N2CCCC(C2)C)c(c((nH)1)N)(N+)(=O)(O))OC
MFCD05727786
ZINC000009357147
ZINC000009357152

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Available files

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