Vitas-M small molecule compound

(2E)-2-cyano-3-(1,2-dimethyl-1H-indol-3-yl)-N-(4-methoxybenzyl)prop-2-enamide

Catalog ID
STK185314
SMILES N#C/C(=C\c1c(C)n(c2c1cccc2)C)/C(=O)NCc1ccc(cc1)OC

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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 C22H21N3O2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2/c1-15-20(19-6-4-5-7-21(19)25(15)2)12-17(13-23)22(26)24-14-16-8-10-18(27-3)11-9-16/h4-12H,14H2,1-3H3,(H,24,26)/b17-12+
InChIKey
SDTKTYCVSLGKJW-SFQUDFHCSA-N
Synonyms

(2E)2CYANO3(12DIMETHYL1HINDOL3YL)N(4METHOXYBENZYL)PROP2ENAMIDE
(E)2CYANO3(12DIMETHYLINDOL3YL)N((4METHOXYPHENYL)METHYL)PROP2ENAMIDE
CC1=C(C2=CC=CC=C2N1C)C=C(C#N)C(=O)NCC3=CC=C(C=C3)OC
InChI=1SC22H21N3O2c11520(19645721(19)25(15)2)1217(1323)22(26)24141681018(273)11916h412H14H213H3(H2426)b1712+
MFCD05041101
N#CC(=Cc1c(C)n(c2c1cccc2)C)C(=O)NCc1ccc(cc1)OC
ZINC000004711034
ZINC04711034
ZINC4711034

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Available files

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