Vitas-M small molecule compound
ethyl 4-[(7Z)-7-(4-methoxybenzylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK724786
SMILES CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1ccc(cc1)OC)/s2
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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 C22H21N3O4S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S/c1-3-29-21(27)16-6-8-17(9-7-16)24-13-23-22-25(14-24)20(26)19(30-22)12-15-4-10-18(28-2)11-5-15/h4-12H,3,13-14H2,1-2H3/b19-12-InChIKey
FLSQYOFSEULGFA-UNOMPAQXSA-NSynonyms
(Z)ethyl4(7(4methoxybenzylidene)6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=C(C=C4)OC)S3
CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1ccc(cc1)OC)s2
ETHYL4((7Z)7((4METHOXYPHENYL)METHYLIDENE)6OXO24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
ethyl4((7Z)7(4methoxybenzylidene)6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
InChI=1SC22H21N3O4Sc132921(27)166817(9716)2413232225(1424)20(26)19(3022)121541018(282)11515h412H31314H212H3b1912
MFCD02997945
ZINC000001239174
ZINC01239174
ZINC1239174
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