Vitas-M small molecule compound

(2E)-2-cyano-N-(2-fluorophenyl)-3-(1-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-1H-indol-3-yl)prop-2-enamide

Catalog ID
STK997721
SMILES COCCNC(=O)Cn1cc(c2c1cccc2)/C=C(/C(=O)Nc1ccccc1F)\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 C23H21FN4O3 MW 420.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN4O3/c1-31-11-10-26-22(29)15-28-14-17(18-6-2-5-9-21(18)28)12-16(13-25)23(30)27-20-8-4-3-7-19(20)24/h2-9,12,14H,10-11,15H2,1H3,(H,26,29)(H,27,30)/b16-12+
InChIKey
PUCVQRWEBVTBDK-FOWTUZBSSA-N
Synonyms
333424-52-5
(2E)2CYANON(2FLUOROPHENYL)3(1((N(2METHOXYETHYL)CARBAMOYL)METHYL)INDOL3YL)PROP2ENAMIDE
(2E)2cyanoN(2fluorophenyl)3(1(2((2methoxyethyl)amino)2oxoethyl)1Hindol3yl)prop2enamide
(E)2cyanoN(2fluorophenyl)3(1(2((2methoxyethyl)amino)2oxoethyl)1Hindol3yl)acrylamide
(E)2CYANON(2FLUOROPHENYL)3(1(2(2METHOXYETHYLAMINO)2OXOETHYL)INDOL3YL)PROP2ENAMIDE
333424525
COCCNC(=O)CN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=CC=CC=C3F
COCCNC(=O)Cn1cc(c2c1cccc2)C=C(C(=O)Nc1ccccc1F)C#N
InChI=1SC23H21FN4O3c13111102622(29)15281417(18625921(18)28)1216(1325)23(30)2720843719(20)24h291214H101115H21H3(H2629)(H2730)b1612+
MFCD02734769
ZINC000001857601
ZINC01857601
ZINC1857601

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.