Vitas-M small molecule compound
(2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide
Catalog ID
STK381451
SMILES N#C/C(=C\c1c[nH]c2c1cc(OCc1ccccc1)cc2)/C(=O)Nc1c(C)cc(cc1C)C
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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 C28H25N3O2 MW 435.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O2/c1-18-11-19(2)27(20(3)12-18)31-28(32)22(15-29)13-23-16-30-26-10-9-24(14-25(23)26)33-17-21-7-5-4-6-8-21/h4-14,16,30H,17H2,1-3H3,(H,31,32)/b22-13+InChIKey
DWNNTJCFYAQBLY-LPYMAVHISA-NSynonyms
676604-95-8(2E)3(5(benzyloxy)1Hindol3yl)2cyanoN(246trimethylphenyl)prop2enamide
(E)2CYANO3(5PHENYLMETHOXY1HINDOL3YL)N(246TRIMETHYLPHENYL)PROP2ENAMIDE
676604958
CC1=CC(=C(C(=C1)C)NC(=O)C(=CC2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4)C#N)C
InChI=1SC28H25N3O2c1181119(2)27(20(3)1218)3128(32)22(1529)132316302610924(1425(23)26)3317217546821h4141630H17H213H3(H3132)b2213+
MFCD02915044
N#CC(=Cc1c(nH)c2c1cc(OCc1ccccc1)cc2)C(=O)Nc1c(C)cc(cc1C)C
ZINC000002807580
ZINC02807580
ZINC2807580
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