Vitas-M small molecule compound

(2E)-2-cyano-3-(1-methyl-1H-indol-3-yl)-N-[5-(naphthalen-1-ylmethyl)-1,3-thiazol-2-yl]prop-2-enamide

Catalog ID
STK952566
SMILES N#C/C(=C\c1cn(c2c1cccc2)C)/C(=O)Nc1ncc(s1)Cc1cccc2c1cccc2

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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 C27H20N4OS MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4OS/c1-31-17-21(24-11-4-5-12-25(24)31)13-20(15-28)26(32)30-27-29-16-22(33-27)14-19-9-6-8-18-7-2-3-10-23(18)19/h2-13,16-17H,14H2,1H3,(H,29,30,32)/b20-13+
InChIKey
RZJPPEIEVIFLGH-DEDYPNTBSA-N
Synonyms

(2E)2cyano3(1methyl1Hindol3yl)N(5(naphthalen1ylmethyl)13thiazol2yl)prop2enamide
(2E)2CYANO3(1METHYLINDOL3YL)N(5(NAPHTHYLMETHYL)(13THIAZOL2YL))PROP2ENAMIDE
(E)2cyano3(1methyl1Hindol3yl)N(5(naphthalen1ylmethyl)thiazol2yl)acrylamideacetate
(E)2CYANO3(1METHYLINDOL3YL)N(5(NAPHTHALEN1YLMETHYL)13THIAZOL2YL)PROP2ENAMIDE
CC(=O)ON#CC(=Cc1cn(c2c1cccc2)C)C(=O)Nc1ncc(s1)Cc1cccc2c1cccc2
CN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=NC=C(S3)CC4=CC=CC5=CC=CC=C54
InChI=1SC27H20N4OSc1311721(2411451225(24)31)1320(1528)26(32)3027291622(3327)1419968187231023(18)19h2131617H14H21H3(H293032)b2013+
MFCD01944156
N#CC(=Cc1cn(c2c1cccc2)C)C(=O)Nc1ncc(s1)Cc1cccc2c1cccc2
ZINC000001453259
ZINC01453259
ZINC1453259

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Available files

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