Vitas-M small molecule compound
ethyl 4-amino-2-[(5-nitropyridin-2-yl)sulfanyl]pyrimidine-5-carboxylate
Catalog ID
STL354916
SMILES CCOC(=O)c1cnc(nc1N)Sc1ccc(cn1)[N+](=O)[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 C12H11N5O4S MW 321.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O4S/c1-2-21-11(18)8-6-15-12(16-10(8)13)22-9-4-3-7(5-14-9)17(19)20/h3-6H,2H2,1H3,(H2,13,15,16)InChIKey
VUTUSUIHBVUSNU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SC2=NC=C(C=C2)(N+)(=O)(O)
CCOC(=O)c1cnc(nc1N)Sc1ccc(cn1)(N+)(=O)(O)
ETHYL4AMINO2((5NITRO2PYRIDYL)THIO)PYRIMIDINE5CARBOXYLATE
ethyl4amino2((5nitropyridin2yl)sulfanyl)pyrimidine5carboxylate
ETHYL4AMINO2(5NITROPYRIDIN2YL)SULFANYLPYRIMIDINE5CARBOXYLATE
InChI=1SC12H11N5O4Sc122111(18)861512(1610(8)13)229437(5149)17(19)20h36H2H21H3(H2131516)
MFCD00116558
ZINC000002161373
ZINC02161373
ZINC2161373
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