Vitas-M small molecule compound
ethyl (2Z)-5-(3-bromo-4-methoxyphenyl)-7-methyl-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL445424
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)Br)OC)c(=O)/c(=C/c1ccc(o1)N1CCOCC1)/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 C26H26BrN3O6S MW 588.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN3O6S/c1-4-35-25(32)22-15(2)28-26-30(23(22)16-5-7-19(33-3)18(27)13-16)24(31)20(37-26)14-17-6-8-21(36-17)29-9-11-34-12-10-29/h5-8,13-14,23H,4,9-12H2,1-3H3/b20-14-InChIKey
MFPAKNRWUVZZMK-ZHZULCJRSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)Br)OC)c(=O)c(=Cc1ccc(o1)N1CCOCC1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)Br)C(=O)C(=CC4=CC=C(O4)N5CCOCC5)S2)C
ethyl(2Z)5(3bromo4methoxyphenyl)7methyl2((5(morpholin4yl)furan2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(3BROMO4METHOXYPHENYL)7METHYL2((5MORPHOLIN4YLFURAN2YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H26BrN3O6Sc143525(32)2215(2)282630(23(22)165719(333)18(27)1316)24(31)20(3726)14176821(3617)2991134121029h58131423H4912H213H3b2014
MFCD02632148
ZINC000000680797
ZINC000000680799
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