Vitas-M small molecule compound
3-nitro-N-[2-(1-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Catalog ID
STK182627
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)nc1n2CCN(C1)C(c1ccccc1)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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-17(18-6-3-2-4-7-18)28-12-13-29-23-11-10-20(15-22(23)27-24(29)16-28)26-25(31)19-8-5-9-21(14-19)30(32)33/h2-11,14-15,17H,12-13,16H2,1H3,(H,26,31)InChIKey
RATKLJABTDIZDC-UHFFFAOYSA-NSynonyms
3nitroN(2(1phenylethyl)1234tetrahydropyrazino(12a)benzimidazol8yl)benzamide
3NITRON(2(1PHENYLETHYL)34DIHYDRO1HPYRAZINO(12A)BENZIMIDAZOL8YL)BENZAMIDE
CC(C1=CC=CC=C1)N2CCN3C(=NC4=C3C=CC(=C4)NC(=O)C5=CC(=CC=C5)(N+)(=O)(O))C2
InChI=1SC25H23N5O3c117(186324718)2812132923111020(1522(23)2724(29)1628)2625(31)1985921(1419)30(32)33h211141517H121316H21H3(H2631)
MFCD06595583
O=C(c1cccc(c1)(N+)(=O)(O))Nc1ccc2c(c1)nc1n2CCN(C1)C(c1ccccc1)C
ZINC000055551759
ZINC000055551760
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