Vitas-M small molecule compound
5-amino-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-1,2-dihydro-3H-pyrrole-3,3,4-tricarbonitrile
Catalog ID
STK540626
SMILES COc1ccc(cc1)N1C(=C(C(C1c1cccc(c1)[N+](=O)[O-])(C#N)C#N)C#N)N
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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 C20H14N6O3 MW 386.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N6O3/c1-29-16-7-5-14(6-8-16)25-18(13-3-2-4-15(9-13)26(27)28)20(11-22,12-23)17(10-21)19(25)24/h2-9,18H,24H2,1H3InChIKey
RFHSTAWCVDYMAA-UHFFFAOYSA-NSynonyms
329928-27-0(2R)5AMINO1(4METHOXYPHENYL)2(3NITROPHENYL)12DIHYDRO3HPYRROLE334TRICARBONITRILE
1HPYRROLE34TRICARBONITRILE5AMINO23DIHYDRO1(4METHOXYPHENYL)2(3NITROPHENYL)
329928270
5amino1(4methoxyphenyl)2(3nitrophenyl)12dihydro3Hpyrrole334tricarbonitrile
5amino1(4methoxyphenyl)2(3nitrophenyl)1Hpyrrole334(2H)tricarbonitrile
5AMINO1(4METHOXYPHENYL)2(3NITROPHENYL)2HPYRROLE334TRICARBONITRILE
5AMINO2(3(HYDROXY(OXIDO)AMINO)PHENYL)1(4METHOXYPHENYL)12DIHYDRO3HPYRROLE334TRICARBONITRILE
COC1=CC=C(C=C1)N2C(C(C(=C2N)C#N)(C#N)C#N)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(cc1)N1C(=C(C(C1c1cccc(c1)(N+)(=O)(O))(C#N)C#N)C#N)N
InChI=1SC20H14N6O3c129167514(6816)2518(1332415(913)26(27)28)20(11221223)17(1021)19(25)24h2918H24H21H3
MFCD03010999
ZINC000001647950
ZINC000001825475
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.