Vitas-M small molecule compound
1,3-dimethyl-5-{[5-(4-nitrophenyl)thiophen-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL120696
SMILES CN1C(=O)N(C)C(=O)C(=Cc2ccc(s2)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 C17H13N3O5S MW 371.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O5S/c1-18-15(21)13(16(22)19(2)17(18)23)9-12-7-8-14(26-12)10-3-5-11(6-4-10)20(24)25/h3-9H,1-2H3InChIKey
PXXLCUSULQKQID-UHFFFAOYSA-NSynonyms
13DIMETHYL5((5(4NITROPHENYL)(2THIENYL))METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
13DIMETHYL5((5(4NITROPHENYL)THIOPHEN2YL)METHYLIDENE)13DIAZINANE246TRIONE
13dimethyl5((5(4nitrophenyl)thiophen2yl)methylidene)pyrimidine246(1H3H5H)trione
CN1C(=O)C(=CC2=CC=C(S2)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)N(C1=O)C
CN1C(=O)N(C)C(=O)C(=Cc2ccc(s2)c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC17H13N3O5Sc11815(21)13(16(22)19(2)17(18)23)9127814(2612)103511(6410)20(24)25h39H12H3
MFCD03819738
ZINC000004540126
ZINC04540126
ZINC4540126
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