Vitas-M small molecule compound
(2Z)-2-(4-ethylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate
Catalog ID
STK924141
SMILES CCc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1
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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 C22H16O4S MW 376.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16O4S/c1-2-14-5-7-15(8-6-14)12-19-21(23)17-10-9-16(13-18(17)26-19)25-22(24)20-4-3-11-27-20/h3-13H,2H2,1H3/b19-12-InChIKey
NNCLKSPDVUMSRI-UNOMPAQXSA-NSynonyms
622362-38-3((2Z)2((4ETHYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)THIOPHENE2CARBOXYLATE
(2Z)2(4ethylbenzylidene)3oxo23dihydro1benzofuran6ylthiophene2carboxylate
(Z)2(4ethylbenzylidene)3oxo23dihydrobenzofuran6ylthiophene2carboxylate
2((4ETHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLTHIOPHENE2CARBOXYLATE
622362383
CCC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4
CCc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1
InChI=1SC22H16O4Sc12145715(8614)121921(23)1710916(1318(17)2619)2522(24)2043112720h313H2H21H3b1912
MFCD04179955
ZINC000013776599
ZINC13776599
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