Vitas-M small molecule compound
(2Z)-2-(5-bromo-3-chloro-2-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
STK331984
SMILES COc1cccc(c1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cc(Br)cc(c1O)Cl)/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 C28H21BrClN3O4S MW 610.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrClN3O4S/c1-15-23(26(35)32-19-8-4-3-5-9-19)24(16-7-6-10-20(12-16)37-2)33-27(36)22(38-28(33)31-15)13-17-11-18(29)14-21(30)25(17)34/h3-14,24,34H,1-2H3,(H,32,35)/b22-13-InChIKey
DTJUCQDJONUGRY-XKZIYDEJSA-NSynonyms
(2Z)2((5bromo3chloro2hydroxyphenyl)methylidene)5(3methoxyphenyl)7methyl3oxoNphenyl5H(13)thiazolo(32a)pyrimidine6carboxamide
(2Z)2(5bromo3chloro2hydroxybenzylidene)5(3methoxyphenyl)7methyl3oxoNphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
CC1=C(C(N2C(=O)C(=CC3=CC(=CC(=C3O)Cl)Br)SC2=N1)C4=CC(=CC=C4)OC)C(=O)NC5=CC=CC=C5
COc1cccc(c1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cc(Br)cc(c1O)Cl)s2)C(=O)Nc1ccccc1
InChI=1SC28H21BrClN3O4Sc11523(26(35)32198435919)24(16761020(1216)372)3327(36)22(3828(33)3115)13171118(29)1421(30)25(17)34h3142434H12H3(H3235)b2213
MFCD09962655
ZINC000097962677
ZINC000097962678
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