Vitas-M small molecule compound
methyl (2Z)-2-(furan-2-ylmethylidene)-5-[4-(methoxycarbonyl)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK813074
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)/c(=C/c1ccco1)/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 C22H18N2O6S MW 438.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O6S/c1-12-17(21(27)29-3)18(13-6-8-14(9-7-13)20(26)28-2)24-19(25)16(31-22(24)23-12)11-15-5-4-10-30-15/h4-11,18H,1-3H3/b16-11-InChIKey
UMPBOSVMJAMGIS-WJDWOHSUSA-NSynonyms
609795-00-8609795008
CC1=C(C(N2C(=O)C(=CC3=CC=CO3)SC2=N1)C4=CC=C(C=C4)C(=O)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)c(=Cc1ccco1)s2
InChI=1SC22H18N2O6Sc11217(21(27)293)18(136814(9713)20(26)282)2419(25)16(3122(24)2312)111554103015h41118H13H3b1611
methyl(2Z)2(furan2ylmethylidene)5(4(methoxycarbonyl)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)2(FURAN2YLMETHYLIDENE)5(4METHOXYCARBONYLPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL2(FURAN2YLMETHYLENE)5(4(METHOXYCARBONYL)PHENYL)7METHYL3OXO35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03518239
ZINC000001467046
ZINC000001467048
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