Vitas-M small molecule compound

ethyl [(5-methyl-6-oxo-5,6-dihydropyrido[2,3-b][1,4]benzothiazepin-8-yl)amino](oxo)acetate

Catalog ID
STL409621
SMILES CCOC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)c1c(S2)nccc1

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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 C17H15N3O4S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O4S/c1-3-24-17(23)14(21)19-10-6-7-13-11(9-10)16(22)20(2)12-5-4-8-18-15(12)25-13/h4-9H,3H2,1-2H3,(H,19,21)
InChIKey
JRZBJXVNWVBQGO-UHFFFAOYSA-N
Synonyms
1574517-49-9
1574517499
CCOC(=O)C(=O)NC1=CC2=C(C=C1)SC3=C(C=CC=N3)N(C2=O)C
ethyl((5methyl6oxo56dihydropyrido(23b)(14)benzothiazepin8yl)amino)(oxo)acetate
ethyl2((5methyl6oxo56dihydrobenzo(f)pyrido(23b)(14)thiazepin8yl)amino)2oxoacetate
ethyl2((5methyl6oxopyrido(23b)(14)benzothiazepin8yl)amino)2oxoacetate
InChI=1SC17H15N3O4Sc132417(23)14(21)1910671311(910)16(22)20(2)125481815(12)2513h49H3H212H3(H1921)
MFCD28058533
ZINC000096231062
ZINC96231062

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Available files

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