Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-2-(4-ethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798164
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(cc1)OCC)/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 C27H26N2O5S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5S/c1-5-15-34-26(31)23-17(3)28-27-29(24(23)19-9-13-20(32-4)14-10-19)25(30)22(35-27)16-18-7-11-21(12-8-18)33-6-2/h5,7-14,16,24H,1,6,15H2,2-4H3/b22-16-InChIKey
KGJXGMXOTREQKC-JWGURIENSA-NSynonyms
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(cc1)OCC)s2
CCOC1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC=C)C4=CC=C(C=C4)OC
InChI=1SC27H26N2O5Sc15153426(31)2317(3)282729(24(23)1991320(324)141019)25(30)22(3527)161871121(12818)3362h57141624H1615H224H3b2216
MFCD03461886
prop2en1yl(2Z)2(4ethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)2((4ETHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000016700180
ZINC000016700182
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