Vitas-M small molecule compound
methyl (2E)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-5-propyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL538410
SMILES CCCc1s/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]c1C(=O)OC
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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 C22H24N4O5S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O5S/c1-3-7-16-18(21(30)31-2)24-22(32-16)23-17(27)12-26-14-9-5-4-8-13(14)19(28)25-11-6-10-15(25)20(26)29/h4-5,8-9,15H,3,6-7,10-12H2,1-2H3,(H,23,24,27)InChIKey
CMAFAUVZGYCTHS-UHFFFAOYSA-NSynonyms
71831347
methyl(2E)2(((511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetyl)imino)5propyl23dihydro13thiazole4carboxylate
methyl2((2(611dioxo6~(a)789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)acetyl)amino)5propyl13thiazole4carboxylate
MFCD31754576
ZINC000072326205
ZINC000101414226
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