Vitas-M small molecule compound
(2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-{2-[(4-methylbenzyl)oxy]phenyl}prop-2-enamide
Catalog ID
STK108053
SMILES N#C/C(=C\c1ccccc1OCc1ccc(cc1)C)/C(=O)NCCc1c[nH]c2c1cccc2
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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/c1-20-10-12-21(13-11-20)19-33-27-9-5-2-6-22(27)16-24(17-29)28(32)30-15-14-23-18-31-26-8-4-3-7-25(23)26/h2-13,16,18,31H,14-15,19H2,1H3,(H,30,32)/b24-16+InChIKey
IRRKHZWHGRTAHP-LFVJCYFKSA-NSynonyms
(2E)2CYANON(2(1HINDOL3YL)ETHYL)3(2((4METHYLBENZYL)OXY)PHENYL)PROP2ENAMIDE
(E)2CYANON(2(1HINDOL3YL)ETHYL)3(2((4METHYLPHENYL)METHOXY)PHENYL)PROP2ENAMIDE
CC1=CC=C(C=C1)COC2=CC=CC=C2C=C(C#N)C(=O)NCCC3=CNC4=CC=CC=C43
InChI=1SC28H25N3O2c120101221(131120)193327952622(27)1624(1729)28(32)30151423183126843725(23)26h213161831H141519H21H3(H3032)b2416+
MFCD03239340
N#CC(=Cc1ccccc1OCc1ccc(cc1)C)C(=O)NCCc1c(nH)c2c1cccc2
ZINC000009323039
ZINC09323039
ZINC9323039
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