Vitas-M small molecule compound
methyl N-{[1-oxo-2-(3,4,5-trifluorophenyl)-1,2-dihydroisoquinolin-4-yl]carbonyl}-beta-alaninate
Catalog ID
STL317443
SMILES COC(=O)CCNC(=O)c1cn(c2cc(F)c(c(c2)F)F)c(=O)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 C20H15F3N2O4 MW 404.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N2O4/c1-29-17(26)6-7-24-19(27)14-10-25(11-8-15(21)18(23)16(22)9-11)20(28)13-5-3-2-4-12(13)14/h2-5,8-10H,6-7H2,1H3,(H,24,27)InChIKey
BOWKPSAUVMYWMS-UHFFFAOYSA-NSynonyms
1435980-99-61435980996
COC(=O)CCNC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC(=C(C(=C3)F)F)F
InChI=1SC20H15F3N2O4c12917(26)672419(27)141025(11815(21)18(23)16(22)911)20(28)13532412(13)14h25810H67H21H3(H2427)
methyl3((1oxo2(345trifluorophenyl)isoquinoline4carbonyl)amino)propanoate
methyl3(1oxo2(345trifluorophenyl)12dihydroisoquinoline4carboxamido)propanoate
methylN((1oxo2(345trifluorophenyl)12dihydroisoquinolin4yl)carbonyl)betaalaninate
MFCD23138521
ZINC000095478541
ZINC95478541
Check stock
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