Vitas-M small molecule compound
2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl 3,5-dinitrobenzoate
Catalog ID
STK719939
SMILES O=C(Nc1nnc(s1)C)COC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C12H9N5O7S MW 367.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N5O7S/c1-6-14-15-12(25-6)13-10(18)5-24-11(19)7-2-8(16(20)21)4-9(3-7)17(22)23/h2-4H,5H2,1H3,(H,13,15,18)InChIKey
WNMYGMGGRALMEJ-UHFFFAOYSA-NSynonyms
(2((5METHYL134THIADIAZOL2YL)AMINO)2OXOETHYL)35DINITROBENZOATE
2((5methyl134thiadiazol2yl)amino)2oxoethyl35dinitrobenzoate
CC1=NN=C(S1)NC(=O)COC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC12H9N5O7Sc16141512(256)1310(18)52411(19)728(16(20)21)49(37)17(22)23h24H5H21H3(H131518)
MFCD01305387
O=C(Nc1nnc(s1)C)COC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
ZINC000003666146
ZINC03666146
ZINC3666146
Check stock
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Check stock on Vitas-MAvailable files
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