Vitas-M small molecule compound
1,3-diethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191645
SMILES CCN1C(=S)N(CC)C(=O)C(=Cc2ccc(o2)c2ccc(cc2)[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 C19H17N3O5S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5S/c1-3-20-17(23)15(18(24)21(4-2)19(20)28)11-14-9-10-16(27-14)12-5-7-13(8-6-12)22(25)26/h5-11H,3-4H2,1-2H3InChIKey
QMEFASFFGGQKND-UHFFFAOYSA-NSynonyms
13diethyl5((5(4nitrophenyl)furan2yl)methylene)2thioxodihydropyrimidine46(1H5H)dione
13DIETHYL5((5(4NITROPHENYL)FURAN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
13DIETHYL5((5(4NITROPHENYL)FURAN2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCN1C(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)N(C1=S)CC
CCN1C(=S)N(CC)C(=O)C(=Cc2ccc(o2)c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC19H17N3O5Sc132017(23)15(18(24)21(42)19(20)28)111491016(2714)125713(8612)22(25)26h511H34H212H3
MFCD02628773
ZINC000004742270
ZINC04742270
ZINC4742270
Check stock
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Check stock on Vitas-MAvailable files
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