Vitas-M small molecule compound

methyl 3-amino-6-[(2-methoxy-2-oxoethyl)sulfanyl]-1-benzothiophene-2-carboxylate

Catalog ID
STK678548
SMILES COC(=O)CSc1ccc2c(c1)sc(c2N)C(=O)OC

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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 C13H13NO4S2 MW 311.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO4S2/c1-17-10(15)6-19-7-3-4-8-9(5-7)20-12(11(8)14)13(16)18-2/h3-5H,6,14H2,1-2H3
InChIKey
HRBLJSMGUKRBPH-UHFFFAOYSA-N
Synonyms

COC(=O)CSC1=CC2=C(C=C1)C(=C(S2)C(=O)OC)N
InChI=1SC13H13NO4S2c11710(15)61973489(57)2012(11(8)14)13(16)182h35H614H212H3
METHYL2(3AMINO2(METHOXYCARBONYL)BENZO(B)THIOPHEN6YLTHIO)ACETATE
methyl3amino6((2methoxy2oxoethyl)sulfanyl)1benzothiophene2carboxylate
METHYL3AMINO6((2METHOXY2OXOETHYL)THIO)1BENZOTHIOPHENE2CARBOXYLATE
METHYL3AMINO6(2METHOXY2OXOETHYL)SULFANYL1BENZOTHIOPHENE2CARBOXYLATE
MFCD03307868
ZINC000000141274
ZINC00141274
ZINC141274

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.