Vitas-M small molecule compound
ethyl 9-(4-bromophenyl)-3-(4-chlorophenyl)-7-methyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate
Catalog ID
STK687437
SMILES CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Br)c1nnn(c(=O)c1s2)c1ccc(cc1)Cl
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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 C24H16BrClN4O3S MW 555.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16BrClN4O3S/c1-3-33-24(32)17-12(2)27-22-19(18(17)13-4-6-14(25)7-5-13)20-21(34-22)23(31)30(29-28-20)16-10-8-15(26)9-11-16/h4-11H,3H2,1-2H3InChIKey
YJBATEIAJHRJST-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2C(=C1C3=CC=C(C=C3)Br)C4=C(S2)C(=O)N(N=N4)C5=CC=C(C=C5)Cl)C
ethyl9(4bromophenyl)3(4chlorophenyl)7methyl4oxo34dihydropyrido(3245)thieno(32d)(123)triazine8carboxylate
ethyl9(4bromophenyl)3(4chlorophenyl)7methyl4oxopyrido(12)thieno(34b)triazine8carboxylate
InChI=1SC24H16BrClN4O3Sc133324(32)1712(2)272219(18(17)134614(25)7513)2021(3422)23(31)30(292820)1610815(26)91116h411H3H212H3
MFCD06618807
ZINC000098008281
ZINC98008281
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