Vitas-M small molecule compound
(2Z)-3-[(4-ethoxyphenyl)amino]-2-[4-(3-oxo-3H-benzo[f]chromen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK529827
SMILES CCOc1ccc(cc1)N/C=C(\c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1)/C#N
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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 C27H19N3O3S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O3S/c1-2-32-20-10-8-19(9-11-20)29-15-18(14-28)26-30-24(16-34-26)23-13-22-21-6-4-3-5-17(21)7-12-25(22)33-27(23)31/h3-13,15-16,29H,2H2,1H3/b18-15-InChIKey
KJRPLFSSMBRCBD-SDXDJHTJSA-NSynonyms
(2Z)3((4ethoxyphenyl)amino)2(4(3oxo3Hbenzo(f)chromen2yl)13thiazol2yl)prop2enenitrile
(Z)3((4ethoxyphenyl)amino)2(4(3oxo3Hbenzo(f)chromen2yl)thiazol2yl)acrylonitrile
(Z)3(4ethoxyanilino)2(4(3oxobenzo(f)chromen2yl)13thiazol2yl)prop2enenitrile
CCOC1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O
CCOc1ccc(cc1)NC=C(c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1)C#N
InChI=1SC27H19N3O3Sc12322010819(91120)291518(1428)263024(163426)23132221643517(21)71225(22)3327(23)31h313151629H2H21H3b1815
MFCD01957572
ZINC000009353387
ZINC09353387
ZINC9353387
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