Vitas-M small molecule compound
ethyl 3-(acetylamino)-4,6-dinitro-1-benzothiophene-2-carboxylate
Catalog ID
STK766964
SMILES CCOC(=O)c1sc2c(c1NC(=O)C)c(cc(c2)[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 C13H11N3O7S MW 353.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O7S/c1-3-23-13(18)12-11(14-6(2)17)10-8(16(21)22)4-7(15(19)20)5-9(10)24-12/h4-5H,3H2,1-2H3,(H,14,17)InChIKey
ISXZFCVWJQJESY-UHFFFAOYSA-NSynonyms
3ACETYLAMINO46DINITROBENZO(B)THIOPHENE2CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C2=C(C=C(C=C2S1)(N+)(=O)(O))(N+)(=O)(O))NC(=O)C
CCOC(=O)c1sc2c(c1NC(=O)C)c(cc(c2)(N+)(=O)(O))(N+)(=O)(O)
ethyl3(acetylamino)46dinitro1benzothiophene2carboxylate
ETHYL3(ACETYLAMINO)46DINITROBENZO(B)THIOPHENE2CARBOXYLATE
ETHYL3ACETAMIDO46DINITRO1BENZOTHIOPHENE2CARBOXYLATE
InChI=1SC13H11N3O7Sc132313(18)1211(146(2)17)108(16(21)22)47(15(19)20)59(10)2412h45H3H212H3(H1417)
MFCD03036467
ZINC000003617937
ZINC03617937
ZINC3617937
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