Vitas-M small molecule compound

(2E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(2-nitrophenyl)prop-2-enamide

Catalog ID
STK698497
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1ccccc1)/C(=O)Nc1ccccc1[N+](=O)[O-]

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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 C25H18N4O3 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N4O3/c26-15-19(25(30)27-22-11-5-7-13-24(22)29(31)32)14-20-17-28(16-18-8-2-1-3-9-18)23-12-6-4-10-21(20)23/h1-14,17H,16H2,(H,27,30)/b19-14+
InChIKey
IALXVNCBMWXPRJ-XMHGGMMESA-N
Synonyms
372970-96-2
(2E)2CYANON(2NITROPHENYL)3(1BENZYLINDOL3YL)PROP2ENAMIDE
(2E)3(1benzyl1Hindol3yl)2cyanoN(2nitrophenyl)prop2enamide
(E)3(1benzyl1Hindol3yl)2cyanoN(2nitrophenyl)acrylamide
(E)3(1BENZYLINDOL3YL)2CYANON(2NITROPHENYL)PROP2ENAMIDE
372970962
C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NC4=CC=CC=C4(N+)(=O)(O)
InChI=1SC25H18N4O3c261519(25(30)272211571324(22)29(31)32)14201728(16188213918)2312641021(20)23h11417H16H2(H2730)b1914+
MFCD01954728
N#CC(=Cc1cn(c2c1cccc2)Cc1ccccc1)C(=O)Nc1ccccc1(N+)(=O)(O)
ZINC000006144157
ZINC6144157

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Available files

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