Vitas-M small molecule compound
ethyl 3-amino-4-(benzylsulfanyl)-6-nitro-1-benzothiophene-2-carboxylate
Catalog ID
STK968203
SMILES CCOC(=O)c1sc2c(c1N)c(SCc1ccccc1)cc(c2)[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 C18H16N2O4S2 MW 388.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4S2/c1-2-24-18(21)17-16(19)15-13(25-10-11-6-4-3-5-7-11)8-12(20(22)23)9-14(15)26-17/h3-9H,2,10,19H2,1H3InChIKey
IVFOQICEKCFPFR-UHFFFAOYSA-NSynonyms
3AMINO4(BENZYLTHIO)6NITROBENZO(B)THIOPHENE2CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C2=C(S1)C=C(C=C2SCC3=CC=CC=C3)(N+)(=O)(O))N
CCOC(=O)c1sc2c(c1N)c(SCc1ccccc1)cc(c2)(N+)(=O)(O)
ethyl3amino4(benzylsulfanyl)6nitro1benzothiophene2carboxylate
ETHYL3AMINO4BENZYLSULFANYL6NITRO1BENZOTHIOPHENE2CARBOXYLATE
InChI=1SC18H16N2O4S2c122418(21)1716(19)1513(2510116435711)812(20(22)23)914(15)2617h39H21019H21H3
MFCD03465350
ZINC000000652380
ZINC00652380
ZINC652380
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