Vitas-M small molecule compound
methyl 4-(2-hydroxy-3,5-dihydrothieno[3,2-e][1,4]thiazepin-5-yl)benzoate
Catalog ID
STL160432
SMILES COC(=O)c1ccc(cc1)C1SCC(=Nc2c1scc2)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 C15H13NO3S2 MW 319.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO3S2/c1-19-15(18)10-4-2-9(3-5-10)13-14-11(6-7-20-14)16-12(17)8-21-13/h2-7,13H,8H2,1H3,(H,16,17)InChIKey
IGEYARBXXOARIC-UHFFFAOYSA-NSynonyms
1310934-99-61310934996
COC(=O)C1=CC=C(C=C1)C2C3=C(C=CS3)NC(=O)CS2
InChI=1SC15H13NO3S2c11915(18)10429(3510)131411(672014)1612(17)82113h2713H8H21H3(H1617)
methyl4(2hydroxy35dihydrothieno(32e)(14)thiazepin5yl)benzoate
methyl4(2oxo15dihydrothieno(32e)(14)thiazepin5yl)benzoate
MFCD20759029
ZINC000071283159
ZINC000071283160
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