Vitas-M small molecule compound

ethyl (2E)-2-{[3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)propanoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate

Catalog ID
STL312523
SMILES CCOC(=O)c1s/c(=N/C(=O)CCC2NC(=O)c3c(N=C2O)cccc3)/[nH]c1C

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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 C19H20N4O5S MW 416.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O5S/c1-3-28-18(27)15-10(2)20-19(29-15)23-14(24)9-8-13-17(26)21-12-7-5-4-6-11(12)16(25)22-13/h4-7,13H,3,8-9H2,1-2H3,(H,21,26)(H,22,25)(H,20,23,24)
InChIKey
VLNNWSPXEJISMI-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1sc(=NC(=O)CCC2NC(=O)c3c(N=C2O)cccc3)(nH)c1C
ethyl(2E)2((3(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)propanoyl)imino)4methyl23dihydro13thiazole5carboxylate
MFCD28026709
ZINC000095474864

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Available files

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