Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)phenyl]-7-methyl-2-[(2-methyl-2H-chromen-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK822296
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C\C1=Cc3ccccc3OC1C)/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 C29H26N2O6S MW 530.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6S/c1-5-35-28(34)25-16(2)30-29-31(26(25)19-10-12-22(13-11-19)37-18(4)32)27(33)24(38-29)15-21-14-20-8-6-7-9-23(20)36-17(21)3/h6-15,17,26H,5H2,1-4H3/b24-15+InChIKey
SSTFVLQSSNSNRY-BUVRLJJBSA-NSynonyms
469879-18-3(E)ethyl5(4acetoxyphenyl)7methyl2((2methyl2Hchromen3yl)methylene)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
469879183
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=CC1=Cc3ccccc3OC1C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC(=O)C)C(=O)C(=CC4=CC5=CC=CC=C5OC4C)S2)C
ethyl(2E)5(4(acetyloxy)phenyl)7methyl2((2methyl2Hchromen3yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxyphenyl)7methyl2((2methyl2Hchromen3yl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H26N2O6Sc153528(34)2516(2)302931(26(25)19101222(131119)3718(4)32)27(33)24(3829)15211420867923(20)3617(21)3h6151726H5H214H3b2415+
MFCD03088851
ZINC000100842276
ZINC000100842281
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