Vitas-M small molecule compound

(2Z)-2-cyano-3-[2,5-dimethyl-1-(4-methyl-3-nitrophenyl)-1H-pyrrol-3-yl]-N-(3-ethoxyphenyl)prop-2-enamide

Catalog ID
STK186477
SMILES CCOc1cccc(c1)NC(=O)/C(=C\c1cc(n(c1C)c1ccc(c(c1)[N+](=O)[O-])C)C)/C#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 C25H24N4O4 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4/c1-5-33-23-8-6-7-21(13-23)27-25(30)20(15-26)12-19-11-17(3)28(18(19)4)22-10-9-16(2)24(14-22)29(31)32/h6-14H,5H2,1-4H3,(H,27,30)/b20-12-
InChIKey
LMGZUPHVNSJCIG-NDENLUEZSA-N
Synonyms
5906-34-3
(2Z)2CYANO3(25DIMETHYL1(4METHYL3NITROPHENYL)1HPYRROL3YL)N(3ETHOXYPHENYL)PROP2ENAMIDE
(Z)2CYANO3(25DIMETHYL1(4METHYL3NITROPHENYL)PYRROL3YL)N(3ETHOXYPHENYL)PROP2ENAMIDE
1HAZEPINE1CARBOXYLICACIDHEXAHYDRO22DIPHENYLHYDRAZIDE
5906343
CCOC1=CC=CC(=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)C)(N+)(=O)(O))C)C#N
CCOc1cccc(c1)NC(=O)C(=Cc1cc(n(c1C)c1ccc(c(c1)(N+)(=O)(O))C)C)C#N
InChI=1SC25H24N4O4c15332386721(1323)2725(30)20(1526)12191117(3)28(18(19)4)2210916(2)24(1422)29(31)32h614H5H214H3(H2730)b2012
MFCD01909674
ZINC000006389478
ZINC06389478
ZINC6389478

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Available files

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