Vitas-M small molecule compound
methyl (2E)-2-{[(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)acetyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL539148
SMILES COC(=O)c1s/c(=N/C(=O)CC2NC(=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 C17H16N4O5S MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O5S/c1-8-13(16(25)26-2)27-17(18-8)21-12(22)7-11-15(24)19-10-6-4-3-5-9(10)14(23)20-11/h3-6,11H,7H2,1-2H3,(H,19,24)(H,20,23)(H,18,21,22)InChIKey
LKFXIZMOEUHTBW-UHFFFAOYSA-NSynonyms
71831368
InChI=1SC17H16N4O5Sc1813(16(25)262)2717(188)2112(22)71115(24)191064359(10)14(23)2011h3611H7H212H3(H1924)(H2023)(H182122)
methyl(2E)2(((2hydroxy5oxo45dihydro3H14benzodiazepin3yl)acetyl)imino)4methyl23dihydro13thiazole5carboxylate
methyl2((2(25dioxo34dihydro1~(H)14benzodiazepin3yl)acetyl)amino)4methyl13thiazole5carboxylate
MFCD31754772
ZINC000085879439
ZINC000101414428
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