Vitas-M small molecule compound
ethyl 4-(2,5-dimethylphenyl)-2-{[(2,4-dinitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK451654
SMILES CCOC(=O)c1c(scc1c1cc(C)ccc1C)NC(=O)c1ccc(cc1[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 C22H19N3O7S MW 469.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O7S/c1-4-32-22(27)19-17(16-9-12(2)5-6-13(16)3)11-33-21(19)23-20(26)15-8-7-14(24(28)29)10-18(15)25(30)31/h5-11H,4H2,1-3H3,(H,23,26)InChIKey
IFUJFJPRZXBDHI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC=C1C2=C(C=CC(=C2)C)C)NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1c(scc1c1cc(C)ccc1C)NC(=O)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
ETHYL2((24BISNITROBENZOYL)AMINO)4(25DIMETHYLPHENYL)3THIOPHENECARBOXYLATE
ethyl4(25dimethylphenyl)2(((24dinitrophenyl)carbonyl)amino)thiophene3carboxylate
ETHYL4(25DIMETHYLPHENYL)2((24DINITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL4(25DIMETHYLPHENYL)2((24DINITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC22H19N3O7Sc143222(27)1917(16912(2)5613(16)3)113321(19)2320(26)158714(24(28)29)1018(15)25(30)31h511H4H213H3(H2326)
MFCD03073270
ZINC000002103647
ZINC02103647
ZINC2103647
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