Vitas-M small molecule compound

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

Catalog ID
STK185298
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)[N+](=O)[O-])C)/C(=O)Nc1cccc(c1)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 C23H20N4O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3/c1-15-5-4-6-20(11-15)25-23(28)19(14-24)13-18-12-16(2)26(17(18)3)21-7-9-22(10-8-21)27(29)30/h4-13H,1-3H3,(H,25,28)/b19-13+
InChIKey
PNOIVJCHAICQLA-CPNJWEJPSA-N
Synonyms
5908-57-6
(2E)2CYANO3(25DIMETHYL1(4NITROPHENYL)1HPYRROL3YL)N(3METHYLPHENYL)PROP2ENAMIDE
(E)2CYANO3(25DIMETHYL1(4NITROPHENYL)PYRROL3YL)N(3METHYLPHENYL)PROP2ENAMIDE
5908576
CC1=CC(=CC=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)(N+)(=O)(O))C)C#N
InChI=1SC23H20N4O3c11554620(1115)2523(28)19(1424)13181216(2)26(17(18)3)217922(10821)27(29)30h413H13H3(H2528)b1913+
MFCD01909700
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)(N+)(=O)(O))C)C(=O)Nc1cccc(c1)C
ZINC000002855352
ZINC02855352
ZINC2855352

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Available files

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