Vitas-M small molecule compound

{5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methanone

Catalog ID
STK303436
SMILES O=C(c1ccc(o1)Cn1nc(c(c1C)[N+](=O)[O-])C)N1CCN2C(C1)CCC2

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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 C18H23N5O4 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O4/c1-12-17(23(25)26)13(2)22(19-12)11-15-5-6-16(27-15)18(24)21-9-8-20-7-3-4-14(20)10-21/h5-6,14H,3-4,7-11H2,1-2H3
InChIKey
MROJLOQJLOSFEV-UHFFFAOYSA-N
Synonyms
1005650-74-7
(5((35dimethyl4nitro1Hpyrazol1yl)methyl)furan2yl)(hexahydropyrrolo(12a)pyrazin2(1H)yl)methanone
1005650747
346788ahexahydro1Hpyrrolo(12a)pyrazin2yl(5((35dimethyl4nitropyrazol1yl)methyl)furan2yl)methanone
CC1=C(C(=NN1CC2=CC=C(O2)C(=O)N3CCN4CCCC4C3)C)(N+)(=O)(O)
InChI=1SC18H23N5O4c11217(23(25)26)13(2)22(1912)11155616(2715)18(24)21982073414(20)1021h5614H34711H212H3
MFCD04043771
O=C(c1ccc(o1)Cn1nc(c(c1C)(N+)(=O)(O))C)N1CCN2C(C1)CCC2
ZINC000002776887
ZINC000002776888

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Available files

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