Vitas-M small molecule compound

ethyl 10-methoxy-3-(2-methoxyethyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate

Catalog ID
STL092804
SMILES COCCN1C(=S)NC2C(C1(C)Oc1c2cccc1OC)C(=O)OCC

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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 C18H24N2O5S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O5S/c1-5-24-16(21)13-14-11-7-6-8-12(23-4)15(11)25-18(13,2)20(9-10-22-3)17(26)19-14/h6-8,13-14H,5,9-10H2,1-4H3,(H,19,26)
InChIKey
NOMWJCUVUPIXQK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1C2C3=C(C(=CC=C3)OC)OC1(N(C(=S)N2)CCOC)C
ethyl10methoxy3(2methoxyethyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxylate
InChI=1SC18H24N2O5Sc152416(21)13141176812(234)15(11)2518(132)20(910223)17(26)1914h681314H5910H214H3(H1926)
MFCD18787042
ZINC000102906370
ZINC000102906372

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Available files

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