Vitas-M small molecule compound
methyl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797756
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccc(cc1)C(C)C)/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 C27H28N2O5S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5S/c1-15(2)18-9-7-17(8-10-18)13-22-25(30)29-24(19-11-12-20(32-4)21(14-19)33-5)23(26(31)34-6)16(3)28-27(29)35-22/h7-15,24H,1-6H3/b22-13-InChIKey
CBCDJURVLKCZRU-XKZIYDEJSA-NSynonyms
(E)methyl5(34dimethoxyphenyl)2(4isopropylbenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)C(C)C)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1)C(C)C)s2
InChI=1SC27H28N2O5Sc115(2)189717(81018)132225(30)2924(19111220(324)21(1419)335)23(26(31)346)16(3)2827(29)3522h71524H16H3b2213
METHYL(2Z)5(34DIMETHOXYPHENYL)7METHYL3OXO2((4PROPAN2YLPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)5(34dimethoxyphenyl)7methyl3oxo2(4(propan2yl)benzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03461754
ZINC000002288530
ZINC000002288532
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