Vitas-M small molecule compound

(2E)-2-cyano-N-[5-(2,5-dichlorobenzyl)-1,3-thiazol-2-yl]-3-(2-methylphenyl)prop-2-enamide

Catalog ID
STL017097
SMILES N#C/C(=C\c1ccccc1C)/C(=O)Nc1ncc(s1)Cc1cc(Cl)ccc1Cl

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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 C21H15Cl2N3OS MW 428.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N3OS/c1-13-4-2-3-5-14(13)8-16(11-24)20(27)26-21-25-12-18(28-21)10-15-9-17(22)6-7-19(15)23/h2-9,12H,10H2,1H3,(H,25,26,27)/b16-8+
InChIKey
BUZUBASAIHZIEJ-LZYBPNLTSA-N
Synonyms

(2E)2cyanoN(5(25dichlorobenzyl)13thiazol2yl)3(2methylphenyl)prop2enamide
(2E)N(5((25DICHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(2METHYLPHENYL)PROP2ENAMIDE
(E)2cyanoN(5((25dichlorophenyl)methyl)13thiazol2yl)3(2methylphenyl)prop2enamide
CC1=CC=CC=C1C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl
InChI=1SC21H15Cl2N3OSc113423514(13)816(1124)20(27)2621251218(2821)1015917(22)6719(15)23h2912H10H21H3(H252627)b168+
MFCD02979369
N#CC(=Cc1ccccc1C)C(=O)Nc1ncc(s1)Cc1cc(Cl)ccc1Cl
ZINC000000954269
ZINC00954269
ZINC954269

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Available files

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