Vitas-M small molecule compound
ethyl (2Z)-2-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK069889
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)/c(=C/c1cc(Br)c(c(c1)OCC)O)/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 C28H29BrN2O6S MW 601.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29BrN2O6S/c1-6-35-21-13-17(12-19(29)25(21)32)14-22-26(33)31-24(18-10-8-9-11-20(18)37-15(3)4)23(27(34)36-7-2)16(5)30-28(31)38-22/h8-15,24,32H,6-7H2,1-5H3/b22-14-InChIKey
NLXIRVBYIGNLAT-HMAPJEAMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)c(=Cc1cc(Br)c(c(c1)OCC)O)s2
CCOC1=C(C(=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=CC=C4OC(C)C)Br)O
ETHYL(2Z)2((3BROMO5ETHOXY4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5(2PROPAN2YLOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(3BROMO5ETHOXY4HYDROXYBENZYLIDENE)7METHYL3OXO5(2(PROPAN2YLOXY)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H29BrN2O6Sc1635211317(1219(29)25(21)32)142226(33)3124(1810891120(18)3715(3)4)23(27(34)3672)16(5)3028(31)3822h8152432H67H215H3b2214
MFCD04083556
STK069889
ZINC000097958914
ZINC000097958915
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