Vitas-M small molecule compound
5-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188172
SMILES CN1C(=S)N(C)C(=O)C(=Cc2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])C1=O
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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 C17H12BrN3O5S MW 450.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrN3O5S/c1-19-15(22)12(16(23)20(2)17(19)27)8-10-4-6-14(26-10)11-5-3-9(21(24)25)7-13(11)18/h3-8H,1-2H3InChIKey
WHSZSLPCRCUJGT-UHFFFAOYSA-NSynonyms
425654-58-6425654586
5((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CN1C(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Br)C(=O)N(C1=S)C
CN1C(=S)N(C)C(=O)C(=Cc2ccc(o2)c2ccc(cc2Br)(N+)(=O)(O))C1=O
InChI=1SC17H12BrN3O5Sc11915(22)12(16(23)20(2)17(19)27)8104614(2610)11539(21(24)25)713(11)18h38H12H3
MFCD02609241
ZINC000001184033
ZINC01184033
ZINC1184033
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