Vitas-M small molecule compound
3-{3-[(1E)-2-cyano-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-1-yl]-2,5-dimethyl-1H-pyrrol-1-yl}-2-methylbenzoic acid
Catalog ID
STK183174
SMILES N#C/C(=C\c1cc(n(c1C)c1cccc(c1C)C(=O)O)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 C28H26N4O3 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3/c1-17-13-21(19(3)32(17)26-10-6-8-23(18(26)2)28(34)35)14-22(15-29)27(33)30-12-11-20-16-31-25-9-5-4-7-24(20)25/h4-10,13-14,16,31H,11-12H2,1-3H3,(H,30,33)(H,34,35)/b22-14+InChIKey
XJJZNCATEWQCAF-HYARGMPZSA-NSynonyms
3(3((1E)2CYANO3((2(1HINDOL3YL)ETHYL)AMINO)3OXOPROP1EN1YL)25DIMETHYL1HPYRROL1YL)2METHYLBENZOICACID
3(3((E)2cyano3(2(1Hindol3yl)ethylamino)3oxoprop1enyl)25dimethylpyrrol1yl)2methylbenzoicacid
CC1=CC(=C(N1C2=CC=CC(=C2C)C(=O)O)C)C=C(C#N)C(=O)NCCC3=CNC4=CC=CC=C43
InChI=1SC28H26N4O3c1171321(19(3)32(17)26106823(18(26)2)28(34)35)1422(1529)27(33)30121120163125954724(20)25h41013141631H1112H213H3(H3033)(H3435)b2214+
MFCD03064686
N#CC(=Cc1cc(n(c1C)c1cccc(c1C)C(=O)O)C)C(=O)NCCc1c(nH)c2c1cccc2
ZINC000009262232
ZINC9262232
Check stock
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