Vitas-M small molecule compound
ethyl 3-amino-6-nitro-4-(phenylsulfanyl)-1-benzothiophene-2-carboxylate
Catalog ID
STK766654
SMILES CCOC(=O)c1sc2c(c1N)c(Sc1ccccc1)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 C17H14N2O4S2 MW 374.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O4S2/c1-2-23-17(20)16-15(18)14-12(24-11-6-4-3-5-7-11)8-10(19(21)22)9-13(14)25-16/h3-9H,2,18H2,1H3InChIKey
LPZVWZGDPOEGFC-UHFFFAOYSA-NSynonyms
3AMINO4(PHENYLTHIO)6NITROBENZO(B)THIOPHENE2CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C2=C(S1)C=C(C=C2SC3=CC=CC=C3)(N+)(=O)(O))N
CCOC(=O)c1sc2c(c1N)c(Sc1ccccc1)cc(c2)(N+)(=O)(O)
ethyl3amino6nitro4(phenylsulfanyl)1benzothiophene2carboxylate
ETHYL3AMINO6NITRO4PHENYLSULFANYL1BENZOTHIOPHENE2CARBOXYLATE
ETHYL3AMINO6NITRO4PHENYLTHIOBENZO(B)THIOPHENE2CARBOXYLATE
InChI=1SC17H14N2O4S2c122317(20)1615(18)1412(24116435711)810(19(21)22)913(14)2516h39H218H21H3
MFCD03017872
ZINC000001001505
ZINC01001505
ZINC1001505
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