Vitas-M small molecule compound
prop-2-en-1-yl (2E)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-(4-propoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797828
SMILES CCCOc1ccc(cc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OCC=C)C
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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 C28H28N2O5S MW 504.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O5S/c1-5-15-34-22-11-7-19(8-12-22)17-23-26(31)30-25(20-9-13-21(33-4)14-10-20)24(27(32)35-16-6-2)18(3)29-28(30)36-23/h6-14,17,25H,2,5,15-16H2,1,3-4H3/b23-17+InChIKey
YUXJBSAJTOOZEN-HAVVHWLPSA-NSynonyms
CCCOC1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC=C)C4=CC=C(C=C4)OC
CCCOc1ccc(cc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OCC=C)C
InChI=1SC28H28N2O5Sc1515342211719(81222)172326(31)3025(2091321(334)141020)24(27(32)351662)18(3)2928(30)3623h6141725H251516H2134H3b2317+
MFCD03417192
prop2en1yl(2E)5(4methoxyphenyl)7methyl3oxo2(4propoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2E)5(4METHOXYPHENYL)7METHYL3OXO2((4PROPOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000016699957
ZINC000016699959
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