Vitas-M small molecule compound

3-[(2-methyl-3-{[3-(morpholin-4-yl)propyl]amino}-4,6-dinitrophenyl)amino]propan-1-ol

Catalog ID
STK093589
SMILES OCCCNc1c(C)c(NCCCN2CCOCC2)c(cc1[N+](=O)[O-])[N+](=O)[O-]

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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 C17H27N5O6 MW 397.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H27N5O6/c1-13-16(18-4-2-6-20-7-10-28-11-8-20)14(21(24)25)12-15(22(26)27)17(13)19-5-3-9-23/h12,18-19,23H,2-11H2,1H3
InChIKey
KMSQOJYOOGPWFU-UHFFFAOYSA-N
Synonyms

3((2METHYL3((3(MORPHOLIN4YL)PROPYL)AMINO)46DINITROPHENYL)AMINO)PROPAN1OL
3((2METHYL3((3MORPHOLIN4YLPROPYL)AMINO)46DINITROPHENYL)AMINO)PROPAN1OL
3((2methyl3((3morpholinopropyl)amino)46dinitrophenyl)amino)propan1olhydrochloride
3(2METHYL3(3MORPHOLIN4YLPROPYLAMINO)46DINITROANILINO)PROPAN1OL
CC1=C(C(=CC(=C1NCCCO)(N+)(=O)(O))(N+)(=O)(O))NCCCN2CCOCC2
InChI=1SC17H27N5O6c11316(18426207102811820)14(21(24)25)1215(22(26)27)17(13)1953923h12181923H211H21H3
MFCD02019165
OCCCNc1c(C)c(NCCCN2CCOCC2)c(cc1(N+)(=O)(O))(N+)(=O)(O)
OCCCNc1c(C)c(NCCCN2CCOCC2)c(cc1(N+)(=O)(O))(N+)(=O)(O)Cl
STK093589
ZINC000019866070
ZINC19866070

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Available files

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