Vitas-M small molecule compound
(2E)-6-benzyl-2-(4-butoxy-3-ethoxybenzylidene)-5-methyl-7H-[1,3]thiazolo[3,2-a]pyrimidine-3,7(2H)-dione
Catalog ID
STK906641
SMILES CCCCOc1ccc(cc1OCC)/C=c\1/sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1
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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 C27H28N2O4S MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O4S/c1-4-6-14-33-22-13-12-20(16-23(22)32-5-2)17-24-26(31)29-18(3)21(25(30)28-27(29)34-24)15-19-10-8-7-9-11-19/h7-13,16-17H,4-6,14-15H2,1-3H3/b24-17+InChIKey
FJNUCWHTEXPRNF-JJIBRWJFSA-NSynonyms
(2E)6benzyl2((4butoxy3ethoxyphenyl)methylidene)5methyl(13)thiazolo(32a)pyrimidine37dione
(2E)6benzyl2(4butoxy3ethoxybenzylidene)5methyl7H(13)thiazolo(32a)pyrimidine37(2H)dione
CCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=C(C(=O)N=C3S2)CC4=CC=CC=C4)C)OCC
CCCCOc1ccc(cc1OCC)C=c1sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1
InChI=1SC27H28N2O4Sc146143322131220(1623(22)3252)172426(31)2918(3)21(25(30)2827(29)3424)1519108791119h7131617H461415H213H3b2417+
MFCD18076367
ZINC000027023052
ZINC27023052
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