Vitas-M small molecule compound
ethyl (2Z)-2-[(5-bromo-1H-indol-3-yl)methylidene]-5-(4-methylphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL440436
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1c[nH]c3c1cc(Br)cc3)/s2)c1ccccc1
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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 C31H24BrN3O3S MW 598.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24BrN3O3S/c1-3-38-30(37)26-27(19-7-5-4-6-8-19)34-31-35(28(26)20-11-9-18(2)10-12-20)29(36)25(39-31)15-21-17-33-24-14-13-22(32)16-23(21)24/h4-17,28,33H,3H2,1-2H3/b25-15-InChIKey
QCHZFQBVKYVHRY-MYYYXRDXSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1c(nH)c3c1cc(Br)cc3)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CNC5=C4C=C(C=C5)Br)S2)C6=CC=CC=C6
ethyl(2Z)2((5bromo1Hindol3yl)methylidene)5(4methylphenyl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5BROMO1HINDOL3YL)METHYLIDENE)5(4METHYLPHENYL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H24BrN3O3Sc133830(37)2627(197546819)343135(28(26)2011918(2)101220)29(36)25(3931)1521173324141322(32)1623(21)24h4172833H3H212H3b2515
MFCD06244584
ZINC000003772332
ZINC000003772334
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