Vitas-M small molecule compound
methyl (2Z)-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2-[2-(prop-2-en-1-yloxy)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698396
SMILES C=CCOc1ccccc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OC)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 C28H28N2O4S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4S/c1-6-15-34-22-10-8-7-9-21(22)16-23-26(31)30-25(20-13-11-19(12-14-20)17(2)3)24(27(32)33-5)18(4)29-28(30)35-23/h6-14,16-17,25H,1,15H2,2-5H3/b23-16-InChIKey
OCUBHFZSLMSQSR-KQWNVCNZSA-NSynonyms
(Z)methyl2(2(allyloxy)benzylidene)5(4isopropylphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
C=CCOc1ccccc1C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OC)C
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3OCC=C)SC2=N1)C4=CC=C(C=C4)C(C)C)C(=O)OC
InChI=1SC28H28N2O4Sc161534221087921(22)162326(31)3025(20131119(121420)17(2)3)24(27(32)335)18(4)2928(30)3523h614161725H115H225H3b2316
methyl(2Z)7methyl3oxo5(4(propan2yl)phenyl)2(2(prop2en1yloxy)benzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)7METHYL3OXO5(4PROPAN2YLPHENYL)2((2PROP2ENOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL2(2(ALLYLOXY)BENZYLIDENE)5(4ISOPROPYLPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01872151
ZINC000002186286
ZINC000002186288
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