Vitas-M small molecule compound
(2E)-2-(3-bromo-4-hydroxybenzylidene)-5-(3-methoxyphenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STK070049
SMILES COc1cccc(c1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccc(c(c1)Br)O)/s2)C(=O)Nc1ccccc1
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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 C28H22BrN3O4S MW 576.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrN3O4S/c1-16-24(26(34)31-19-8-4-3-5-9-19)25(18-7-6-10-20(15-18)36-2)32-27(35)23(37-28(32)30-16)14-17-11-12-22(33)21(29)13-17/h3-15,25,33H,1-2H3,(H,31,34)/b23-14+InChIKey
WKSFWXRKWSUZJK-OEAKJJBVSA-NSynonyms
(2E)2((3bromo4hydroxyphenyl)methylidene)5(3methoxyphenyl)7methyl3oxoNphenyl5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2(3BROMO4HYDROXYBENZYLIDENE)5(3METHOXYPHENYL)7METHYL3OXONPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)O)Br)SC2=N1)C4=CC(=CC=C4)OC)C(=O)NC5=CC=CC=C5
COc1cccc(c1)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(c(c1)Br)O)s2)C(=O)Nc1ccccc1
InChI=1SC28H22BrN3O4Sc11624(26(34)31198435919)25(18761020(1518)362)3227(35)23(3728(32)3016)1417111222(33)21(29)1317h3152533H12H3(H3134)b2314+
MFCD04083731
STK070049
ZINC000097958917
ZINC000097958918
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